[4-bromanyl-2-[(E)-(hexadecanoylhydrazinylidene)methyl]phenyl] 3-methylbenzoate

Systemtic Name: [4-bromanyl-2-[(E)-(hexadecanoylhydrazinylidene)methyl]phenyl] 3-methylbenzoate Openeye Name: [4-bromo-2-[(E)-(hexadecanoylhydrazono)methyl]phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [4-bromo-2-[(E)-(1-oxohexadecylhydrazinylidene)methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-(hexadecanoylhydrazinylidene)methyl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [4-bromo-2-[(E)-(hexadecanoylhydrazono)methyl]phenyl] ester Formula: C31H43BrN2O3 MolecularWeight: 571.58872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NN=CC1=C(C=CC(=C1)Br)OC(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N/N=C/C1=C(C=CC(=C1)Br)OC(=O)C2=CC(=CC=C2)C

InChI

InChI=1S/C31H43BrN2O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-30(35)34-33-24-27-23-28(32)20-21-29(27)37-31(36)26-18-16-17-25(2)22-26/h16-18,20-24H,3-15,19H2,1-2H3,(H,34,35)/b33-24+