[4-bromanyl-2-[(E)-[2-(dodecanoylamino)ethanoylhydrazinylidene]methyl]phenyl] 4-propoxybenzoate

Systemtic Name: [4-bromanyl-2-[(E)-[2-(dodecanoylamino)ethanoylhydrazinylidene]methyl]phenyl] 4-propoxybenzoate Openeye Name: [4-bromo-2-[(E)-[[2-(dodecanoylamino)acetyl]hydrazono]methyl]phenyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [4-bromo-2-[(E)-[[1-oxo-2-(1-oxododecylamino)ethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[[2-(dodecanoylamino)acetyl]hydrazinylidene]methyl]phenyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [4-bromo-2-[(E)-[[2-(lauroylamino)acetyl]hydrazono]methyl]phenyl] ester Formula: C31H42BrN3O5 MolecularWeight: 616.58628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H42BrN3O5/c1-3-5-6-7-8-9-10-11-12-13-29(36)33-23-30(37)35-34-22-25-21-26(32)16-19-28(25)40-31(38)24-14-17-27(18-15-24)39-20-4-2/h14-19,21-22H,3-13,20,23H2,1-2H3,(H,33,36)(H,35,37)/b34-22+