tetradecyl 4-[[4-(2,3-dimethyl-4-oxidanyl-5-oxidanylidene-pyrazol-1-yl)phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: tetradecyl 4-[[4-(2,3-dimethyl-4-oxidanyl-5-oxidanylidene-pyrazol-1-yl)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: tetradecyl 4-[4-(4-hydroxy-2,3-dimethyl-5-oxo-pyrazol-1-yl)anilino]-4-oxo-butanoate CAS Name: 4-[4-(4-hydroxy-2,3-dimethyl-5-oxo-1-pyrazolyl)anilino]-4-oxobutanoic acid tetradecyl ester IUPAC Name: tetradecyl 4-[4-(4-hydroxy-2,3-dimethyl-5-oxopyrazol-1-yl)anilino]-4-oxobutanoate Traditional Name: 4-[4-(4-hydroxy-5-keto-2,3-dimethyl-3-pyrazolin-1-yl)anilino]-4-keto-butyric acid myristyl ester Formula: C29H45N3O5 MolecularWeight: 515.6847

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)CCC(=O)NC1=CC=C(C=C1)N2C(=O)C(=C(N2C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)CCC(=O)NC1=CC=C(C=C1)N2C(=O)C(=C(N2C)C)O

InChI

InChI=1S/C29H45N3O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-22-37-27(34)21-20-26(33)30-24-16-18-25(19-17-24)32-29(36)28(35)23(2)31(32)3/h16-19,35H,4-15,20-22H2,1-3H3,(H,30,33)