[4-[(E)-[2-(4-nitrophenoxy)ethanoylhydrazinylidene]methyl]phenyl] 4-butoxybenzoate

Systemtic Name: [4-[(E)-[2-(4-nitrophenoxy)ethanoylhydrazinylidene]methyl]phenyl] 4-butoxybenzoate Openeye Name: [4-[(E)-[[2-(4-nitrophenoxy)acetyl]hydrazono]methyl]phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [4-[(E)-[[2-(4-nitrophenoxy)-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[[2-(4-nitrophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [4-[(E)-[[2-(4-nitrophenoxy)acetyl]hydrazono]methyl]phenyl] ester Formula: C26H25N3O7 MolecularWeight: 491.4926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H25N3O7/c1-2-3-16-34-22-12-6-20(7-13-22)26(31)36-24-10-4-19(5-11-24)17-27-28-25(30)18-35-23-14-8-21(9-15-23)29(32)33/h4-15,17H,2-3,16,18H2,1H3,(H,28,30)/b27-17+