methyl 4-(4-indol-1-ylbutyl)-2-methyl-benzoate

Systemtic Name: methyl 4-(4-indol-1-ylbutyl)-2-methyl-benzoate Openeye Name: methyl 4-(4-indol-1-ylbutyl)-2-methyl-benzoate CAS Name: 4-[4-(1-indolyl)butyl]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 4-(4-indol-1-ylbutyl)-2-methylbenzoate Traditional Name: 4-(4-indol-1-ylbutyl)-2-methyl-benzoic acid methyl ester Formula: C21H23NO2 MolecularWeight: 321.41282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCCCN2C=CC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)CCCCN2C=CC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C21H23NO2/c1-16-15-17(10-11-19(16)21(23)24-2)7-5-6-13-22-14-12-18-8-3-4-9-20(18)22/h3-4,8-12,14-15H,5-7,13H2,1-2H3