[1-(4-methoxyphenyl)-2-methyl-3-(phenylcarbonyl)indol-5-yl] 3-methylbutanoate

Systemtic Name: [1-(4-methoxyphenyl)-2-methyl-3-(phenylcarbonyl)indol-5-yl] 3-methylbutanoate Openeye Name: [3-benzoyl-1-(4-methoxyphenyl)-2-methyl-indol-5-yl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [3-benzoyl-1-(4-methoxyphenyl)-2-methyl-5-indolyl] ester IUPAC Name: [3-benzoyl-1-(4-methoxyphenyl)-2-methylindol-5-yl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [3-benzoyl-1-(4-methoxyphenyl)-2-methyl-indol-5-yl] ester Formula: C28H27NO4 MolecularWeight: 441.51828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C=CC(=C2)OC(=O)CC(C)C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C=CC(=C2)OC(=O)CC(C)C)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H27NO4/c1-18(2)16-26(30)33-23-14-15-25-24(17-23)27(28(31)20-8-6-5-7-9-20)19(3)29(25)21-10-12-22(32-4)13-11-21/h5-15,17-18H,16H2,1-4H3