[2-ethoxy-4-[(E)-(methoxycarbonylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate

Systemtic Name: [2-ethoxy-4-[(E)-(methoxycarbonylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate Openeye Name: [2-ethoxy-4-[(E)-(methoxycarbonylhydrazono)methyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-ethoxy-4-[(E)-(methoxycarbonylhydrazinylidene)methyl]phenyl] ester IUPAC Name: [2-ethoxy-4-[(E)-(methoxycarbonylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[(E)-(carbomethoxyhydrazono)methyl]-2-ethoxy-phenyl] ester Formula: C18H17N3O7 MolecularWeight: 387.34348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=O)OC)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N/NC(=O)OC)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O7/c1-3-27-16-9-12(11-19-20-18(23)26-2)7-8-15(16)28-17(22)13-5-4-6-14(10-13)21(24)25/h4-11H,3H2,1-2H3,(H,20,23)/b19-11+