Chem
J-GLOBAL ID:200907009259155999
Nikkaji number:J546.670I
1H-Indole-3-carboxylic acid (8-methyltropan-8-ium)-3α-yl ester
1H-インドール-3-カルボン酸(8-メチルトロパン-8-イウム)-3α-イル
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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:
C18 H23 N[N+]O2
Molecular formula furigana:
C18-H23-N2-O2
Molecular weight:
299.393
InChI:
InChI=1S/C18H22N2O2/c1-20(2)12-7-8-13(20)10-14(9-12)22-18(21)16-11-19-17-6-4-3-5-15(16)17/h3-6,11-14H,7-10H2,1-2H3/p+1
InChI key:
KVDHVTQKKLVMJD-UHFFFAOYSA-O
SMILES:
C[N+]1(C)C2CCC1CC(C2)OC(=O)c1c[nH]c2ccccc12
Systematic name (3):
1H-インドール-3-カルボン酸(8-メチルトロパン-8-イウム)-3α-イル
3-(1H-インドール-3-カルボニルオキシ)-8,8-ジメチル-8-アザビシクロ[3.2.1]オクタン-8-イウム
3-(1H-indole-3-carbonyloxy)-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium
Other name (1):
1H-Indole-3-carboxylic acid (8-methyltropan-8-ium)-3α-yl ester
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