methyl 4-[[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-phenyl-methyl]amino]benzoate

Systemtic Name: methyl 4-[[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-phenyl-methyl]amino]benzoate Openeye Name: methyl 4-[[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-phenyl-methyl]amino]benzoate CAS Name: 4-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-phenylmethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-phenylmethyl]amino]benzoate Traditional Name: 4-[[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-phenyl-methyl]amino]benzoic acid methyl ester Formula: C26H25N3O3 MolecularWeight: 427.495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C3=CC=CC=C3)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C3=CC=CC=C3)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C26H25N3O3/c1-18-23(25(30)29(28(18)2)22-12-8-5-9-13-22)24(19-10-6-4-7-11-19)27-21-16-14-20(15-17-21)26(31)32-3/h4-17,24,27H,1-3H3