hexadecyl 4-[(2Z)-2-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]benzoate

Systemtic Name: hexadecyl 4-[(2Z)-2-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]benzoate Openeye Name: hexadecyl 4-[(2Z)-2-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)hydrazino]benzoate CAS Name: 4-[(2Z)-2-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)hydrazinyl]benzoic acid hexadecyl ester IUPAC Name: hexadecyl 4-[(2Z)-2-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)hydrazinyl]benzoate Traditional Name: 4-[(N'Z)-N'-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)hydrazino]benzoic acid cetyl ester Formula: C33H46N4O3 MolecularWeight: 546.74334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)NN=C2C(=NN(C2=O)C3=CC=CC=C3)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)N/N=C\2/C(=NN(C2=O)C3=CC=CC=C3)C

InChI

InChI=1S/C33H46N4O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-26-40-33(39)28-22-24-29(25-23-28)34-35-31-27(2)36-37(32(31)38)30-20-17-16-18-21-30/h16-18,20-25,34H,3-15,19,26H2,1-2H3/b35-31-