ethyl 3-[[2-(6-chloranylpyridin-3-yl)carbonylpyrazolidin-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[2-(6-chloranylpyridin-3-yl)carbonylpyrazolidin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[2-(6-chloropyridine-3-carbonyl)pyrazolidine-1-carbonyl]amino]benzoate CAS Name: 3-[[[2-[(6-chloro-3-pyridinyl)-oxomethyl]-1-pyrazolidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(6-chloropyridine-3-carbonyl)pyrazolidine-1-carbonyl]amino]benzoate Traditional Name: 3-[[2-(6-chloronicotinoyl)pyrazolidine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C19H19ClN4O4 MolecularWeight: 402.83156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCCN2C(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCCN2C(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C19H19ClN4O4/c1-2-28-18(26)13-5-3-6-15(11-13)22-19(27)24-10-4-9-23(24)17(25)14-7-8-16(20)21-12-14/h3,5-8,11-12H,2,4,9-10H2,1H3,(H,22,27)