2-[5-(4-chlorophenyl)carbonyl-4-ethoxy-1-methyl-pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[5-(4-chlorophenyl)carbonyl-4-ethoxy-1-methyl-pyrrol-2-yl]ethanoic acid Openeye Name: 2-[5-(4-chlorobenzoyl)-4-ethoxy-1-methyl-pyrrol-2-yl]acetic acid CAS Name: 2-[5-[(4-chlorophenyl)-oxomethyl]-4-ethoxy-1-methyl-2-pyrrolyl]acetic acid IUPAC Name: 2-[5-(4-chlorobenzoyl)-4-ethoxy-1-methylpyrrol-2-yl]acetic acid Traditional Name: 2-[5-(4-chlorobenzoyl)-4-ethoxy-1-methyl-pyrrol-2-yl]acetic acid Formula: C16H16ClNO4 MolecularWeight: 321.75554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(N(C(=C1)CC(=O)O)C)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC1=C(N(C(=C1)CC(=O)O)C)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H16ClNO4/c1-3-22-13-8-12(9-14(19)20)18(2)15(13)16(21)10-4-6-11(17)7-5-10/h4-8H,3,9H2,1-2H3,(H,19,20)