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

Systemtic Name: 2-[1-(4-butoxyphenyl)carbonyl-5-methoxy-2-methyl-indol-4-yl]ethanoic acid Openeye Name: 2-[1-(4-butoxybenzoyl)-5-methoxy-2-methyl-indol-4-yl]acetic acid CAS Name: 2-[1-[(4-butoxyphenyl)-oxomethyl]-5-methoxy-2-methyl-4-indolyl]acetic acid IUPAC Name: 2-[1-(4-butoxybenzoyl)-5-methoxy-2-methylindol-4-yl]acetic acid Traditional Name: 2-[1-(4-butoxybenzoyl)-5-methoxy-2-methyl-indol-4-yl]acetic acid Formula: C23H25NO5 MolecularWeight: 395.4483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2C(=CC3=C2C=CC(=C3CC(=O)O)OC)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2C(=CC3=C2C=CC(=C3CC(=O)O)OC)C

InChI

InChI=1S/C23H25NO5/c1-4-5-12-29-17-8-6-16(7-9-17)23(27)24-15(2)13-18-19(14-22(25)26)21(28-3)11-10-20(18)24/h6-11,13H,4-5,12,14H2,1-3H3,(H,25,26)