methyl (3R)-4-methyl-2-(4-nitrophenyl)-5-phenyl-3,4-dihydropyrazole-3-carboxylate

Systemtic Name: methyl (3R)-4-methyl-2-(4-nitrophenyl)-5-phenyl-3,4-dihydropyrazole-3-carboxylate Openeye Name: methyl (3R)-4-methyl-2-(4-nitrophenyl)-5-phenyl-3,4-dihydropyrazole-3-carboxylate CAS Name: (3R)-4-methyl-2-(4-nitrophenyl)-5-phenyl-3,4-dihydropyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-4-methyl-2-(4-nitrophenyl)-5-phenyl-3,4-dihydropyrazole-3-carboxylate Traditional Name: (3R)-4-methyl-2-(4-nitrophenyl)-5-phenyl-2-pyrazoline-3-carboxylic acid methyl ester Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1[C@@H](N(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H17N3O4/c1-12-16(13-6-4-3-5-7-13)19-20(17(12)18(22)25-2)14-8-10-15(11-9-14)21(23)24/h3-12,17H,1-2H3/t12?,17-/m1/s1