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

Systemtic Name: [4-bromanyl-2-[(E)-[2-(tetradecanoylamino)ethanoylhydrazinylidene]methyl]phenyl] 4-propoxybenzoate Openeye Name: [4-bromo-2-[(E)-[[2-(tetradecanoylamino)acetyl]hydrazono]methyl]phenyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [4-bromo-2-[(E)-[[1-oxo-2-(1-oxotetradecylamino)ethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[[2-(tetradecanoylamino)acetyl]hydrazinylidene]methyl]phenyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [4-bromo-2-[(E)-[[2-(tetradecanoylamino)acetyl]hydrazono]methyl]phenyl] ester Formula: C33H46BrN3O5 MolecularWeight: 644.63944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H46BrN3O5/c1-3-5-6-7-8-9-10-11-12-13-14-15-31(38)35-25-32(39)37-36-24-27-23-28(34)18-21-30(27)42-33(40)26-16-19-29(20-17-26)41-22-4-2/h16-21,23-24H,3-15,22,25H2,1-2H3,(H,35,38)(H,37,39)/b36-24+