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

Systemtic Name: 2-[2-methyl-1-(3-pentoxyphenyl)carbonyl-indol-4-yl]ethanoic acid Openeye Name: 2-[2-methyl-1-(3-pentoxybenzoyl)indol-4-yl]acetic acid CAS Name: 2-[2-methyl-1-[oxo-(3-pentoxyphenyl)methyl]-4-indolyl]acetic acid IUPAC Name: 2-[2-methyl-1-(3-pentoxybenzoyl)indol-4-yl]acetic acid Traditional Name: 2-[1-(3-amoxybenzoyl)-2-methyl-indol-4-yl]acetic acid Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C(=O)N2C(=CC3=C(C=CC=C32)CC(=O)O)C

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)C(=O)N2C(=CC3=C(C=CC=C32)CC(=O)O)C

InChI

InChI=1S/C23H25NO4/c1-3-4-5-12-28-19-10-6-9-18(14-19)23(27)24-16(2)13-20-17(15-22(25)26)8-7-11-21(20)24/h6-11,13-14H,3-5,12,15H2,1-2H3,(H,25,26)