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

Systemtic Name: butyl 4-[[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-(4-methoxyphenyl)methyl]amino]benzoate Openeye Name: butyl 4-[[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-(4-methoxyphenyl)methyl]amino]benzoate CAS Name: 4-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-(4-methoxyphenyl)methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-(4-methoxyphenyl)methyl]amino]benzoate Traditional Name: 4-[[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-(4-methoxyphenyl)methyl]amino]benzoic acid butyl ester Formula: C30H33N3O4 MolecularWeight: 499.60072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(C2=CC=C(C=C2)OC)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(C2=CC=C(C=C2)OC)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C30H33N3O4/c1-5-6-20-37-30(35)23-12-16-24(17-13-23)31-28(22-14-18-26(36-4)19-15-22)27-21(2)32(3)33(29(27)34)25-10-8-7-9-11-25/h7-19,28,31H,5-6,20H2,1-4H3