[[C-(4-azanyl-1,2,5-oxadiazol-3-yl)-N-(4-methylphenyl)carbonimidoyl]amino] benzoate

Systemtic Name: [[C-(4-azanyl-1,2,5-oxadiazol-3-yl)-N-(4-methylphenyl)carbonimidoyl]amino] benzoate Openeye Name: [[C-(4-amino-1,2,5-oxadiazol-3-yl)-N-(p-tolyl)carbonimidoyl]amino] benzoate CAS Name: benzoic acid [[(4-amino-1,2,5-oxadiazol-3-yl)-(4-methylphenyl)iminomethyl]amino] ester IUPAC Name: [[C-(4-amino-1,2,5-oxadiazol-3-yl)-N-(4-methylphenyl)carbonimidoyl]amino] benzoate Traditional Name: benzoic acid [[C-(4-aminofurazan-3-yl)-N-(p-tolyl)carbonimidoyl]amino] ester Formula: C17H15N5O3 MolecularWeight: 337.3327

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C(C2=NON=C2N)NOC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N=C(C2=NON=C2N)NOC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H15N5O3/c1-11-7-9-13(10-8-11)19-16(14-15(18)21-25-20-14)22-24-17(23)12-5-3-2-4-6-12/h2-10H,1H3,(H2,18,21)(H,19,22)