sodium 2-[2-[5-(4-chlorophenyl)carbonyl-1,4-dimethyl-pyrrol-2-yl]ethanoylamino]ethanoate

Systemtic Name: sodium 2-[2-[5-(4-chlorophenyl)carbonyl-1,4-dimethyl-pyrrol-2-yl]ethanoylamino]ethanoate Openeye Name: sodium 2-[[2-[5-(4-chlorobenzoyl)-1,4-dimethyl-pyrrol-2-yl]acetyl]amino]acetate CAS Name: sodium 2-[[2-[5-[(4-chlorophenyl)-oxomethyl]-1,4-dimethyl-2-pyrrolyl]-1-oxoethyl]amino]acetate IUPAC Name: sodium 2-[[2-[5-(4-chlorobenzoyl)-1,4-dimethylpyrrol-2-yl]acetyl]amino]acetate Traditional Name: sodium 2-[[2-[5-(4-chlorobenzoyl)-1,4-dimethyl-pyrrol-2-yl]acetyl]amino]acetate Formula: C17H16ClN2NaO4 MolecularWeight: 370.76271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1)CC(=O)NCC(=O)[O-])C)C(=O)C2=CC=C(C=C2)Cl.[Na+]

Isomeric SMILES

CC1=C(N(C(=C1)CC(=O)NCC(=O)[O-])C)C(=O)C2=CC=C(C=C2)Cl.[Na+]

InChI

InChI=1S/C17H17ClN2O4.Na/c1-10-7-13(8-14(21)19-9-15(22)23)20(2)16(10)17(24)11-3-5-12(18)6-4-11;/h3-7H,8-9H2,1-2H3,(H,19,21)(H,22,23);/q;+1/p-1