methyl 6-[2-(3-acetamidophenyl)carbonylpyrazolidin-1-yl]carbonylpyridine-3-carboxylate

Systemtic Name: methyl 6-[2-(3-acetamidophenyl)carbonylpyrazolidin-1-yl]carbonylpyridine-3-carboxylate Openeye Name: methyl 6-[2-(3-acetamidobenzoyl)pyrazolidine-1-carbonyl]pyridine-3-carboxylate CAS Name: 6-[[2-[(3-acetamidophenyl)-oxomethyl]-1-pyrazolidinyl]-oxomethyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[2-(3-acetamidobenzoyl)pyrazolidine-1-carbonyl]pyridine-3-carboxylate Traditional Name: 6-[2-(3-acetamidobenzoyl)pyrazolidine-1-carbonyl]nicotinic acid methyl ester Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)N2CCCN2C(=O)C3=NC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)N2CCCN2C(=O)C3=NC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H20N4O5/c1-13(25)22-16-6-3-5-14(11-16)18(26)23-9-4-10-24(23)19(27)17-8-7-15(12-21-17)20(28)29-2/h3,5-8,11-12H,4,9-10H2,1-2H3,(H,22,25)