2-[1-(4-butoxyphenyl)carbonyl-3-[(4-methoxyphenyl)methyl]-2-methyl-indol-4-yl]ethanoic acid

Systemtic Name: 2-[1-(4-butoxyphenyl)carbonyl-3-[(4-methoxyphenyl)methyl]-2-methyl-indol-4-yl]ethanoic acid Openeye Name: 2-[1-(4-butoxybenzoyl)-3-[(4-methoxyphenyl)methyl]-2-methyl-indol-4-yl]acetic acid CAS Name: 2-[1-[(4-butoxyphenyl)-oxomethyl]-3-[(4-methoxyphenyl)methyl]-2-methyl-4-indolyl]acetic acid IUPAC Name: 2-[1-(4-butoxybenzoyl)-3-[(4-methoxyphenyl)methyl]-2-methylindol-4-yl]acetic acid Traditional Name: 2-[1-(4-butoxybenzoyl)-2-methyl-3-p-anisyl-indol-4-yl]acetic acid Formula: C30H31NO5 MolecularWeight: 485.57084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2C(=C(C3=C(C=CC=C32)CC(=O)O)CC4=CC=C(C=C4)OC)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2C(=C(C3=C(C=CC=C32)CC(=O)O)CC4=CC=C(C=C4)OC)C

InChI

InChI=1S/C30H31NO5/c1-4-5-17-36-25-15-11-22(12-16-25)30(34)31-20(2)26(18-21-9-13-24(35-3)14-10-21)29-23(19-28(32)33)7-6-8-27(29)31/h6-16H,4-5,17-19H2,1-3H3,(H,32,33)