[1-[2-(3,4-dimethoxyphenyl)ethyl]-3-ethanoyl-2-methyl-indol-5-yl] 4-methylbenzoate

Systemtic Name: [1-[2-(3,4-dimethoxyphenyl)ethyl]-3-ethanoyl-2-methyl-indol-5-yl] 4-methylbenzoate Openeye Name: [3-acetyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-indol-5-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [3-acetyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-indolyl] ester IUPAC Name: [3-acetyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methylindol-5-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (3-acetyl-1-homoveratryl-2-methyl-indol-5-yl) ester Formula: C29H29NO5 MolecularWeight: 471.54426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)N(C(=C3C(=O)C)C)CCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)N(C(=C3C(=O)C)C)CCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C29H29NO5/c1-18-6-9-22(10-7-18)29(32)35-23-11-12-25-24(17-23)28(20(3)31)19(2)30(25)15-14-21-8-13-26(33-4)27(16-21)34-5/h6-13,16-17H,14-15H2,1-5H3