2-[ethanoyl-[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]amino]ethanoic acid

Systemtic Name: 2-[ethanoyl-[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]amino]ethanoic acid Openeye Name: 2-[acetyl-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]amino]acetic acid CAS Name: 2-[acetyl-[1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolyl]amino]acetic acid IUPAC Name: 2-[acetyl-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]amino]acetic acid Traditional Name: 2-[acetyl-(1-methyl-5-p-toluoyl-pyrrol-2-yl)amino]acetic acid Formula: C17H18N2O4 MolecularWeight: 314.33582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)N(CC(=O)O)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)N(CC(=O)O)C(=O)C

InChI

InChI=1S/C17H18N2O4/c1-11-4-6-13(7-5-11)17(23)14-8-9-15(18(14)3)19(12(2)20)10-16(21)22/h4-9H,10H2,1-3H3,(H,21,22)