1-[(3S)-5-methyl-3-(2-nitrophenyl)-2-phenyl-1,3-dihydropyrazol-4-yl]ethanone

Systemtic Name: 1-[(3S)-5-methyl-3-(2-nitrophenyl)-2-phenyl-1,3-dihydropyrazol-4-yl]ethanone Openeye Name: 1-[(3S)-5-methyl-3-(2-nitrophenyl)-2-phenyl-1,3-dihydropyrazol-4-yl]ethanone CAS Name: 1-[(3S)-5-methyl-3-(2-nitrophenyl)-2-phenyl-1,3-dihydropyrazol-4-yl]ethanone IUPAC Name: 1-[(3S)-5-methyl-3-(2-nitrophenyl)-2-phenyl-1,3-dihydropyrazol-4-yl]ethanone Traditional Name: 1-[(5S)-3-methyl-5-(2-nitrophenyl)-1-phenyl-3-pyrazolin-4-yl]ethanone Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(N1)C2=CC=CC=C2)C3=CC=CC=C3[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=C([C@@H](N(N1)C2=CC=CC=C2)C3=CC=CC=C3[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C18H17N3O3/c1-12-17(13(2)22)18(15-10-6-7-11-16(15)21(23)24)20(19-12)14-8-4-3-5-9-14/h3-11,18-19H,1-2H3/t18-/m0/s1