(6-chloranylpyridin-3-yl)methyl 4-[(2-nitrophenyl)amino]butanoate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 4-[(2-nitrophenyl)amino]butanoate Openeye Name: (6-chloro-3-pyridyl)methyl 4-(2-nitroanilino)butanoate CAS Name: 4-(2-nitroanilino)butanoic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 4-(2-nitroanilino)butanoate Traditional Name: 4-(2-nitroanilino)butyric acid (6-chloro-3-pyridyl)methyl ester Formula: C16H16ClN3O4 MolecularWeight: 349.76894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NCCCC(=O)OCC2=CN=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NCCCC(=O)OCC2=CN=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H16ClN3O4/c17-15-8-7-12(10-19-15)11-24-16(21)6-3-9-18-13-4-1-2-5-14(13)20(22)23/h1-2,4-5,7-8,10,18H,3,6,9,11H2