dimethyl 1-[(1R,2R)-2-benzamido-3-methoxy-3-oxidanylidene-1-phenyl-propyl]-5-(4-methoxyphenyl)pyrazole-3,4-dicarboxylate

Systemtic Name: dimethyl 1-[(1R,2R)-2-benzamido-3-methoxy-3-oxidanylidene-1-phenyl-propyl]-5-(4-methoxyphenyl)pyrazole-3,4-dicarboxylate Openeye Name: dimethyl 1-[(1R,2R)-2-benzamido-3-methoxy-3-oxo-1-phenyl-propyl]-5-(4-methoxyphenyl)pyrazole-3,4-dicarboxylate CAS Name: 1-[(1R,2R)-2-benzamido-3-methoxy-3-oxo-1-phenylpropyl]-5-(4-methoxyphenyl)pyrazole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[(1R,2R)-2-benzamido-3-methoxy-3-oxo-1-phenylpropyl]-5-(4-methoxyphenyl)pyrazole-3,4-dicarboxylate Traditional Name: 1-[(1R,2R)-2-benzamido-3-keto-3-methoxy-1-phenyl-propyl]-5-(4-methoxyphenyl)pyrazole-3,4-dicarboxylic acid dimethyl ester Formula: C31H29N3O8 MolecularWeight: 571.57726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=NN2C(C3=CC=CC=C3)C(C(=O)OC)NC(=O)C4=CC=CC=C4)C(=O)OC)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=NN2[C@H](C3=CC=CC=C3)[C@H](C(=O)OC)NC(=O)C4=CC=CC=C4)C(=O)OC)C(=O)OC

InChI

InChI=1S/C31H29N3O8/c1-39-22-17-15-20(16-18-22)26-23(29(36)40-2)24(30(37)41-3)33-34(26)27(19-11-7-5-8-12-19)25(31(38)42-4)32-28(35)21-13-9-6-10-14-21/h5-18,25,27H,1-4H3,(H,32,35)/t25-,27-/m1/s1