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

Systemtic Name: [2-methoxy-4-[(E)-[2-(2-nitrophenoxy)ethanoylhydrazinylidene]methyl]phenyl] 4-butoxybenzoate Openeye Name: [2-methoxy-4-[(E)-[[2-(2-nitrophenoxy)acetyl]hydrazono]methyl]phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-methoxy-4-[(E)-[[2-(2-nitrophenoxy)-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-[[2-(2-nitrophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-methoxy-4-[(E)-[[2-(2-nitrophenoxy)acetyl]hydrazono]methyl]phenyl] ester Formula: C27H27N3O8 MolecularWeight: 521.51858

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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)COC3=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)COC3=CC=CC=C3[N+](=O)[O-])OC

InChI

InChI=1S/C27H27N3O8/c1-3-4-15-36-21-12-10-20(11-13-21)27(32)38-24-14-9-19(16-25(24)35-2)17-28-29-26(31)18-37-23-8-6-5-7-22(23)30(33)34/h5-14,16-17H,3-4,15,18H2,1-2H3,(H,29,31)/b28-17+