carboxy 2-[1,4-dimethyl-5-(2-methylphenyl)carbonyl-pyrrol-2-yl]ethanoate

Systemtic Name: carboxy 2-[1,4-dimethyl-5-(2-methylphenyl)carbonyl-pyrrol-2-yl]ethanoate Openeye Name: carboxy 2-[1,4-dimethyl-5-(2-methylbenzoyl)pyrrol-2-yl]acetate CAS Name: 2-[1,4-dimethyl-5-[(2-methylphenyl)-oxomethyl]-2-pyrrolyl]acetic acid carboxy ester IUPAC Name: carboxy 2-[1,4-dimethyl-5-(2-methylbenzoyl)pyrrol-2-yl]acetate Traditional Name: 2-(1,4-dimethyl-5-o-toluoyl-pyrrol-2-yl)acetic acid carboxy ester Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=C(C=C(N2C)CC(=O)OC(=O)O)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=C(C=C(N2C)CC(=O)OC(=O)O)C

InChI

InChI=1S/C17H17NO5/c1-10-6-4-5-7-13(10)16(20)15-11(2)8-12(18(15)3)9-14(19)23-17(21)22/h4-8H,9H2,1-3H3,(H,21,22)