methyl (4S)-4-(1,3-diphenylpyrazol-4-yl)-2,6-dimethyl-5-nitro-3,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl (4S)-4-(1,3-diphenylpyrazol-4-yl)-2,6-dimethyl-5-nitro-3,4-dihydropyridine-3-carboxylate Openeye Name: methyl (4S)-4-(1,3-diphenylpyrazol-4-yl)-2,6-dimethyl-5-nitro-3,4-dihydropyridine-3-carboxylate CAS Name: (4S)-4-(1,3-diphenyl-4-pyrazolyl)-2,6-dimethyl-5-nitro-3,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-4-(1,3-diphenylpyrazol-4-yl)-2,6-dimethyl-5-nitro-3,4-dihydropyridine-3-carboxylate Traditional Name: (4S)-4-(1,3-diphenylpyrazol-4-yl)-2,6-dimethyl-5-nitro-3,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C24H22N4O4 MolecularWeight: 430.45588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OC)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)OC)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C24H22N4O4/c1-15-20(24(29)32-3)21(23(28(30)31)16(2)25-15)19-14-27(18-12-8-5-9-13-18)26-22(19)17-10-6-4-7-11-17/h4-14,20-21H,1-3H3/t20?,21-/m1/s1