2-[3-carboxy-5-(4-chlorophenyl)carbonyl-2-ethyl-4-methyl-pyrrol-2-yl]ethanoate

Systemtic Name: 2-[3-carboxy-5-(4-chlorophenyl)carbonyl-2-ethyl-4-methyl-pyrrol-2-yl]ethanoate Openeye Name: 2-[3-carboxy-5-(4-chlorobenzoyl)-2-ethyl-4-methyl-pyrrol-2-yl]acetate CAS Name: 2-[3-carboxy-5-[(4-chlorophenyl)-oxomethyl]-2-ethyl-4-methyl-2-pyrrolyl]acetate IUPAC Name: 2-[3-carboxy-5-(4-chlorobenzoyl)-2-ethyl-4-methylpyrrol-2-yl]acetate Traditional Name: 2-[3-carboxy-5-(4-chlorobenzoyl)-2-ethyl-4-methyl-pyrrol-2-yl]acetate Formula: C17H15ClNO5- MolecularWeight: 348.7577

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=C(C(=N1)C(=O)C2=CC=C(C=C2)Cl)C)C(=O)O)CC(=O)[O-]

Isomeric SMILES

CCC1(C(=C(C(=N1)C(=O)C2=CC=C(C=C2)Cl)C)C(=O)O)CC(=O)[O-]

InChI

InChI=1S/C17H16ClNO5/c1-3-17(8-12(20)21)13(16(23)24)9(2)14(19-17)15(22)10-4-6-11(18)7-5-10/h4-7H,3,8H2,1-2H3,(H,20,21)(H,23,24)/p-1