[4-[(E)-(octadecanoylhydrazinylidene)methyl]phenyl] 3-methylbenzoate

Systemtic Name: [4-[(E)-(octadecanoylhydrazinylidene)methyl]phenyl] 3-methylbenzoate Openeye Name: [4-[(E)-(octadecanoylhydrazono)methyl]phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [4-[(E)-(1-oxooctadecylhydrazinylidene)methyl]phenyl] ester IUPAC Name: [4-[(E)-(octadecanoylhydrazinylidene)methyl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [4-[(E)-(stearoylhydrazono)methyl]phenyl] ester Formula: C33H48N2O3 MolecularWeight: 520.74582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NN=CC1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N/N=C/C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)C

InChI

InChI=1S/C33H48N2O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-32(36)35-34-27-29-22-24-31(25-23-29)38-33(37)30-20-18-19-28(2)26-30/h18-20,22-27H,3-17,21H2,1-2H3,(H,35,36)/b34-27+