methyl 1-but-3-enyl-3-cyclohexyl-2-(2-ethenylphenyl)indole-6-carboxylate

Systemtic Name: methyl 1-but-3-enyl-3-cyclohexyl-2-(2-ethenylphenyl)indole-6-carboxylate Openeye Name: methyl 1-but-3-enyl-3-cyclohexyl-2-(2-vinylphenyl)indole-6-carboxylate CAS Name: 1-but-3-enyl-3-cyclohexyl-2-(2-ethenylphenyl)-6-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-but-3-enyl-3-cyclohexyl-2-(2-ethenylphenyl)indole-6-carboxylate Traditional Name: 1-but-3-enyl-3-cyclohexyl-2-(2-vinylphenyl)indole-6-carboxylic acid methyl ester Formula: C28H31NO2 MolecularWeight: 413.55124

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=C(N2CCC=C)C3=CC=CC=C3C=C)C4CCCCC4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=C(N2CCC=C)C3=CC=CC=C3C=C)C4CCCCC4

InChI

InChI=1S/C28H31NO2/c1-4-6-18-29-25-19-22(28(30)31-3)16-17-24(25)26(21-13-8-7-9-14-21)27(29)23-15-11-10-12-20(23)5-2/h4-5,10-12,15-17,19,21H,1-2,6-9,13-14,18H2,3H3