[3-[(heptanoylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate

Systemtic Name: [3-[(heptanoylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate Openeye Name: [3-[(heptanoylhydrazono)methyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [3-[(1-oxoheptylhydrazinylidene)methyl]phenyl] ester IUPAC Name: [3-[(heptanoylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [3-[(enanthylhydrazono)methyl]phenyl] ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NN=CC1=CC(=CC=C1)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCC(=O)NN=CC1=CC(=CC=C1)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5/c1-2-3-4-5-12-20(25)23-22-15-16-8-6-11-19(13-16)29-21(26)17-9-7-10-18(14-17)24(27)28/h6-11,13-15H,2-5,12H2,1H3,(H,23,25)