[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] 4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] 4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: [2-[(5-chloro-2-pyridyl)amino]-2-oxo-ethyl] 4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl] 4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [2-[(5-chloro-2-pyridyl)amino]-2-keto-ethyl] ester Formula: C16H18ClN3O4 MolecularWeight: 351.78482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(C)O)C)C(=O)OCC(=O)NC2=NC=C(C=C2)Cl

Isomeric SMILES

CC1=C(NC(=C1C(C)O)C)C(=O)OCC(=O)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C16H18ClN3O4/c1-8-14(10(3)21)9(2)19-15(8)16(23)24-7-13(22)20-12-5-4-11(17)6-18-12/h4-6,10,19,21H,7H2,1-3H3,(H,18,20,22)