[1-oxidanylidene-1-(1-phenylbutylamino)propan-2-yl] 2-chloranylpyridine-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-(1-phenylbutylamino)propan-2-yl] 2-chloranylpyridine-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(1-phenylbutylamino)ethyl] 2-chloropyridine-4-carboxylate CAS Name: 2-chloro-4-pyridinecarboxylic acid [1-oxo-1-(1-phenylbutylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(1-phenylbutylamino)propan-2-yl] 2-chloropyridine-4-carboxylate Traditional Name: 2-chloroisonicotinic acid [2-keto-1-methyl-2-(1-phenylbutylamino)ethyl] ester Formula: C19H21ClN2O3 MolecularWeight: 360.83464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)C2=CC(=NC=C2)Cl

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)C2=CC(=NC=C2)Cl

InChI

InChI=1S/C19H21ClN2O3/c1-3-7-16(14-8-5-4-6-9-14)22-18(23)13(2)25-19(24)15-10-11-21-17(20)12-15/h4-6,8-13,16H,3,7H2,1-2H3,(H,22,23)