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

Systemtic Name: [1-(4-methoxyphenyl)-2-methyl-3-(phenylcarbonyl)indol-5-yl] pentanoate Openeye Name: [3-benzoyl-1-(4-methoxyphenyl)-2-methyl-indol-5-yl] pentanoate CAS Name: pentanoic acid [3-benzoyl-1-(4-methoxyphenyl)-2-methyl-5-indolyl] ester IUPAC Name: [3-benzoyl-1-(4-methoxyphenyl)-2-methylindol-5-yl] pentanoate Traditional Name: valeric 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:

CCCCC(=O)OC1=CC2=C(C=C1)N(C(=C2C(=O)C3=CC=CC=C3)C)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCCC(=O)OC1=CC2=C(C=C1)N(C(=C2C(=O)C3=CC=CC=C3)C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C28H27NO4/c1-4-5-11-26(30)33-23-16-17-25-24(18-23)27(28(31)20-9-7-6-8-10-20)19(2)29(25)21-12-14-22(32-3)15-13-21/h6-10,12-18H,4-5,11H2,1-3H3