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

Systemtic Name: [2-methoxy-4-[(E)-[(2-methylphenyl)carbonylhydrazinylidene]methyl]phenyl] 4-butoxybenzoate Openeye Name: [2-methoxy-4-[(E)-[(2-methylbenzoyl)hydrazono]methyl]phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-methoxy-4-[(E)-[[(2-methylphenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-[(2-methylbenzoyl)hydrazinylidene]methyl]phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-methoxy-4-[(E)-(o-toluoylhydrazono)methyl]phenyl] ester Formula: C27H28N2O5 MolecularWeight: 460.52162

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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=C3C)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)/C=N/NC(=O)C3=CC=CC=C3C)OC

InChI

InChI=1S/C27H28N2O5/c1-4-5-16-33-22-13-11-21(12-14-22)27(31)34-24-15-10-20(17-25(24)32-3)18-28-29-26(30)23-9-7-6-8-19(23)2/h6-15,17-18H,4-5,16H2,1-3H3,(H,29,30)/b28-18+