2-[3-methoxycarbonyl-5-methyl-4-[2-(phenylmethyl)phenyl]carbonyl-1H-pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[3-methoxycarbonyl-5-methyl-4-[2-(phenylmethyl)phenyl]carbonyl-1H-pyrrol-2-yl]ethanoic acid Openeye Name: 2-[4-(2-benzylbenzoyl)-3-methoxycarbonyl-5-methyl-1H-pyrrol-2-yl]acetic acid CAS Name: 2-[3-methoxycarbonyl-5-methyl-4-[oxo-[2-(phenylmethyl)phenyl]methyl]-1H-pyrrol-2-yl]acetic acid IUPAC Name: 2-[4-(2-benzylbenzoyl)-3-methoxycarbonyl-5-methyl-1H-pyrrol-2-yl]acetic acid Traditional Name: 2-[4-(2-benzylbenzoyl)-3-carbomethoxy-5-methyl-1H-pyrrol-2-yl]acetic acid Formula: C23H21NO5 MolecularWeight: 391.41654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)CC(=O)O)C(=O)OC)C(=O)C2=CC=CC=C2CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(N1)CC(=O)O)C(=O)OC)C(=O)C2=CC=CC=C2CC3=CC=CC=C3

InChI

InChI=1S/C23H21NO5/c1-14-20(21(23(28)29-2)18(24-14)13-19(25)26)22(27)17-11-7-6-10-16(17)12-15-8-4-3-5-9-15/h3-11,24H,12-13H2,1-2H3,(H,25,26)