methyl 3-methanoyl-1-(4-phenylbutyl)indole-5-carboxylate

Systemtic Name: methyl 3-methanoyl-1-(4-phenylbutyl)indole-5-carboxylate Openeye Name: methyl 3-formyl-1-(4-phenylbutyl)indole-5-carboxylate CAS Name: 3-formyl-1-(4-phenylbutyl)-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-formyl-1-(4-phenylbutyl)indole-5-carboxylate Traditional Name: 3-formyl-1-(4-phenylbutyl)indole-5-carboxylic acid methyl ester Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C=C2C=O)CCCCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C=C2C=O)CCCCC3=CC=CC=C3

InChI

InChI=1S/C21H21NO3/c1-25-21(24)17-10-11-20-19(13-17)18(15-23)14-22(20)12-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,10-11,13-15H,5-6,9,12H2,1H3