2-[5-methoxy-2-methyl-1-(4-pentylphenyl)carbonyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-methoxy-2-methyl-1-(4-pentylphenyl)carbonyl-indol-3-yl]ethanoic acid Openeye Name: 2-[5-methoxy-2-methyl-1-(4-pentylbenzoyl)indol-3-yl]acetic acid CAS Name: 2-[5-methoxy-2-methyl-1-[oxo-(4-pentylphenyl)methyl]-3-indolyl]acetic acid IUPAC Name: 2-[5-methoxy-2-methyl-1-(4-pentylbenzoyl)indol-3-yl]acetic acid Traditional Name: 2-[1-(4-amylbenzoyl)-5-methoxy-2-methyl-indol-3-yl]acetic acid Formula: C24H27NO4 MolecularWeight: 393.47548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N2C(=C(C3=C2C=CC(=C3)OC)CC(=O)O)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N2C(=C(C3=C2C=CC(=C3)OC)CC(=O)O)C

InChI

InChI=1S/C24H27NO4/c1-4-5-6-7-17-8-10-18(11-9-17)24(28)25-16(2)20(15-23(26)27)21-14-19(29-3)12-13-22(21)25/h8-14H,4-7,15H2,1-3H3,(H,26,27)