2-(6-methyl-2-nitro-pyridin-3-yl)oxy-1-[(3S)-5-naphthalen-2-yl-3-phenyl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-(6-methyl-2-nitro-pyridin-3-yl)oxy-1-[(3S)-5-naphthalen-2-yl-3-phenyl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-[(6-methyl-2-nitro-3-pyridyl)oxy]-1-[(3S)-5-(2-naphthyl)-3-phenyl-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-[(6-methyl-2-nitro-3-pyridinyl)oxy]-1-[(3S)-5-(2-naphthalenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-(6-methyl-2-nitropyridin-3-yl)oxy-1-[(3S)-5-naphthalen-2-yl-3-phenyl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-[(6-methyl-2-nitro-3-pyridyl)oxy]-1-[(5S)-3-(2-naphthyl)-5-phenyl-2-pyrazolin-1-yl]ethanone Formula: C27H22N4O4 MolecularWeight: 466.48798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)OCC(=O)N2C(CC(=N2)C3=CC4=CC=CC=C4C=C3)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C=C1)OCC(=O)N2[C@@H](CC(=N2)C3=CC4=CC=CC=C4C=C3)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H22N4O4/c1-18-11-14-25(27(28-18)31(33)34)35-17-26(32)30-24(20-8-3-2-4-9-20)16-23(29-30)22-13-12-19-7-5-6-10-21(19)15-22/h2-15,24H,16-17H2,1H3/t24-/m0/s1