[4-[(E)-[2-(dodecanoylamino)ethanoylhydrazinylidene]methyl]phenyl] 3-methylbenzoate

Systemtic Name: [4-[(E)-[2-(dodecanoylamino)ethanoylhydrazinylidene]methyl]phenyl] 3-methylbenzoate Openeye Name: [4-[(E)-[[2-(dodecanoylamino)acetyl]hydrazono]methyl]phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [4-[(E)-[[1-oxo-2-(1-oxododecylamino)ethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[[2-(dodecanoylamino)acetyl]hydrazinylidene]methyl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [4-[(E)-[[2-(lauroylamino)acetyl]hydrazono]methyl]phenyl] ester Formula: C29H39N3O4 MolecularWeight: 493.63766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NCC(=O)NN=CC1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CCCCCCCCCCCC(=O)NCC(=O)N/N=C/C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)C

InChI

InChI=1S/C29H39N3O4/c1-3-4-5-6-7-8-9-10-11-15-27(33)30-22-28(34)32-31-21-24-16-18-26(19-17-24)36-29(35)25-14-12-13-23(2)20-25/h12-14,16-21H,3-11,15,22H2,1-2H3,(H,30,33)(H,32,34)/b31-21+