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

Systemtic Name: dimethyl 1-[(1R,2R)-2-benzamido-3-methoxy-3-oxidanylidene-1-phenyl-propyl]-5-(4-nitrophenyl)pyrazole-3,4-dicarboxylate Openeye Name: dimethyl 1-[(1R,2R)-2-benzamido-3-methoxy-3-oxo-1-phenyl-propyl]-5-(4-nitrophenyl)pyrazole-3,4-dicarboxylate CAS Name: 1-[(1R,2R)-2-benzamido-3-methoxy-3-oxo-1-phenylpropyl]-5-(4-nitrophenyl)pyrazole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[(1R,2R)-2-benzamido-3-methoxy-3-oxo-1-phenylpropyl]-5-(4-nitrophenyl)pyrazole-3,4-dicarboxylate Traditional Name: 1-[(1R,2R)-2-benzamido-3-keto-3-methoxy-1-phenyl-propyl]-5-(4-nitrophenyl)pyrazole-3,4-dicarboxylic acid dimethyl ester Formula: C30H26N4O9 MolecularWeight: 586.54884

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1C(=O)OC)C(C2=CC=CC=C2)C(C(=O)OC)NC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(N(N=C1C(=O)OC)[C@H](C2=CC=CC=C2)[C@H](C(=O)OC)NC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C30H26N4O9/c1-41-28(36)22-23(29(37)42-2)32-33(25(22)19-14-16-21(17-15-19)34(39)40)26(18-10-6-4-7-11-18)24(30(38)43-3)31-27(35)20-12-8-5-9-13-20/h4-17,24,26H,1-3H3,(H,31,35)/t24-,26-/m1/s1