N-[3-[(3-cyanophenyl)methoxy]phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-[3-[(3-cyanophenyl)methoxy]phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[3-[(3-cyanophenyl)methoxy]phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[3-[(3-cyanophenyl)methoxy]phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[3-[(3-cyanophenyl)methoxy]phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[3-(3-cyanobenzyl)oxyphenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C23H16N6O4 MolecularWeight: 440.41094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)COC2=CC=CC(=C2)NC(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)COC2=CC=CC(=C2)NC(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-])C#N

InChI

InChI=1S/C23H16N6O4/c24-12-16-3-1-4-17(9-16)13-33-20-6-2-5-19(11-20)27-23(30)18-7-8-21(22(10-18)29(31)32)28-15-25-14-26-28/h1-11,14-15H,13H2,(H,27,30)