[4-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]phenyl] 4-propoxybenzoate

Systemtic Name: [4-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]phenyl] 4-propoxybenzoate Openeye Name: [4-[(E)-(pyridine-3-carbonylhydrazono)methyl]phenyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [4-[(E)-[[oxo(3-pyridinyl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-(pyridine-3-carbonylhydrazinylidene)methyl]phenyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [4-[(E)-(nicotinoylhydrazono)methyl]phenyl] ester Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)C3=CN=CC=C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C23H21N3O4/c1-2-14-29-20-11-7-18(8-12-20)23(28)30-21-9-5-17(6-10-21)15-25-26-22(27)19-4-3-13-24-16-19/h3-13,15-16H,2,14H2,1H3,(H,26,27)/b25-15+