2-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1,4-dimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 2-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1,4-dimethyl-pyrrole-3-carboxylic acid Openeye Name: 2-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]-1,4-dimethyl-pyrrole-3-carboxylic acid CAS Name: 2-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-1,4-dimethyl-3-pyrrolecarboxylic acid IUPAC Name: 2-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-1,4-dimethylpyrrole-3-carboxylic acid Traditional Name: 2-[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]-1,4-dimethyl-pyrrole-3-carboxylic acid Formula: C16H17ClN2O3 MolecularWeight: 320.77078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=C1C(=O)O)CC(=O)NC2=C(C(=CC=C2)Cl)C)C

Isomeric SMILES

CC1=CN(C(=C1C(=O)O)CC(=O)NC2=C(C(=CC=C2)Cl)C)C

InChI

InChI=1S/C16H17ClN2O3/c1-9-8-19(3)13(15(9)16(21)22)7-14(20)18-12-6-4-5-11(17)10(12)2/h4-6,8H,7H2,1-3H3,(H,18,20)(H,21,22)