Chem
J-GLOBAL ID:200907092231237056
Nikkaji number:J747.294C
6-[2-(1H-Tetrazol-5-yl)ethyl]-1,2,3,4-tetrahydroisoquinoline-3β-carboxylic acid
6-[2-(1H-テトラゾール-5-イル)エチル]-1,2,3,4-テトラヒドロイソキノリン-3β-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:
C13 H15 N5 O2
Molecular formula furigana:
C13-H15-N5-O2
Molecular weight:
273.296
InChI:
InChI=1S/C13H15N5O2/c19-13(20)11-6-10-5-8(1-3-9(10)7-14-11)2-4-12-15-17-18-16-12/h1,3,5,11,14H,2,4,6-7H2,(H,19,20)(H,15,16,17,18)/t11-/m1/s1
InChI key:
LARWZWKWUAHZKD-LLVKDONJSA-N
SMILES:
OC(=O)[C@H]1Cc2cc(CCc3nnn[nH]3)ccc2CN1
Systematic name (3):
6-[2-(1H-テトラゾール-5-イル)エチル]-1,2,3,4-テトラヒドロイソキノリン-3β-カルボン酸
(3R)-6-[2-(1H-1,2,3,4-テトラゾール-5-イル)エチル]-1,2,3,4-テトラヒドロイソキノリン-3-カルボン酸
(3R)-6-[2-(1H-1,2,3,4-tetrazol-5-yl)ethyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
Other name (1):
6-[2-(1H-Tetrazol-5-yl)ethyl]-1,2,3,4-tetrahydroisoquinoline-3β-carboxylic acid
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