(3R,6S)-6-heptyl-3-methyl-1-(4-nitrophenyl)sulfonyl-5-phenyl-3,6-dihydro-2H-pyridine

Systemtic Name: (3R,6S)-6-heptyl-3-methyl-1-(4-nitrophenyl)sulfonyl-5-phenyl-3,6-dihydro-2H-pyridine Openeye Name: (3R,6S)-6-heptyl-3-methyl-1-(4-nitrophenyl)sulfonyl-5-phenyl-3,6-dihydro-2H-pyridine CAS Name: (3R,6S)-6-heptyl-3-methyl-1-(4-nitrophenyl)sulfonyl-5-phenyl-3,6-dihydro-2H-pyridine IUPAC Name: (3R,6S)-6-heptyl-3-methyl-1-(4-nitrophenyl)sulfonyl-5-phenyl-3,6-dihydro-2H-pyridine Traditional Name: (3R,6S)-6-heptyl-3-methyl-1-nosyl-5-phenyl-3,6-dihydro-2H-pyridine Formula: C25H32N2O4S MolecularWeight: 456.59758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(=CC(CN1S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C)C3=CC=CC=C3

Isomeric SMILES

CCCCCCC[C@H]1C(=C[C@H](CN1S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C)C3=CC=CC=C3

InChI

InChI=1S/C25H32N2O4S/c1-3-4-5-6-10-13-25-24(21-11-8-7-9-12-21)18-20(2)19-26(25)32(30,31)23-16-14-22(15-17-23)27(28)29/h7-9,11-12,14-18,20,25H,3-6,10,13,19H2,1-2H3/t20-,25+/m1/s1