[2-methoxy-4-[(E)-[(3-nitrophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-butoxybenzoate

Systemtic Name: [2-methoxy-4-[(E)-[(3-nitrophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-butoxybenzoate Openeye Name: [2-methoxy-4-[(E)-[(3-nitrobenzoyl)hydrazono]methyl]phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-methoxy-4-[(E)-[[(3-nitrophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-[(3-nitrobenzoyl)hydrazinylidene]methyl]phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-methoxy-4-[(E)-[(3-nitrobenzoyl)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=C(C=C(C=C2)C=NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

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

InChI

InChI=1S/C26H25N3O7/c1-3-4-14-35-22-11-9-19(10-12-22)26(31)36-23-13-8-18(15-24(23)34-2)17-27-28-25(30)20-6-5-7-21(16-20)29(32)33/h5-13,15-17H,3-4,14H2,1-2H3,(H,28,30)/b27-17+