Chem
J-GLOBAL ID:200907035967178738
Nikkaji number:J949.729C
4α-Cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexane-1β-carboxylic acid
4α-シアノ-4-(3-シクロペンチルオキシ-4-メトキシフェニル)シクロヘキサン-1β-カルボン酸
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C20 H25 NO4
Molecular formula furigana:
C20-H25-N-O4
Molecular weight:
343.423
InChI:
InChI=1S/C20H25NO4/c1-24-17-7-6-15(12-18(17)25-16-4-2-3-5-16)20(13-21)10-8-14(9-11-20)19(22)23/h6-7,12,14,16H,2-5,8-11H2,1H3,(H,22,23)/t14-,20+
InChI key:
CFBUZOUXXHZCFB-LDTOLXSISA-N
SMILES:
COc1ccc(cc1OC1CCCC1)[C@@]1(CC[C@@H](CC1)C(=O)O)C#N
Systematic name (4):
4α-シアノ-4-(3-シクロペンチルオキシ-4-メトキシフェニル)シクロヘキサン-1β-カルボン酸
4α-シアノ-4-[3-(シクロペンチルオキシ)-4-メトキシフェニル]-1β-シクロヘキサンカルボン酸
(1r,4r)-4-シアノ-4-[3-(シクロペンチルオキシ)-4-メトキシフェニル]シクロヘキサン-1-カルボン酸
(1r,4r)-4-cyano-4-[3-(cyclopentyloxy)-4-methoxyphenyl]cyclohexane-1-carboxylic acid
Other name (2):
4α-Cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexane-1β-carboxylic acid
4α-Cyano-4-[3-(cyclopentyloxy)-4-methoxyphenyl]-1β-cyclohexanecarboxylic acid
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