O5-(4,4-diphenylpiperidin-1-yl) O3-methyl (4S)-2,6-dimethyl-4-(3-nitrophenyl)-1-propyl-4H-pyridine-3,5-dicarboxylate

Systemtic Name: O5-(4,4-diphenylpiperidin-1-yl) O3-methyl (4S)-2,6-dimethyl-4-(3-nitrophenyl)-1-propyl-4H-pyridine-3,5-dicarboxylate Openeye Name: O5-(4,4-diphenyl-1-piperidyl) O3-methyl (4S)-2,6-dimethyl-4-(3-nitrophenyl)-1-propyl-4H-pyridine-3,5-dicarboxylate CAS Name: (4S)-2,6-dimethyl-4-(3-nitrophenyl)-1-propyl-4H-pyridine-3,5-dicarboxylic acid O5-(4,4-diphenyl-1-piperidinyl) ester O3-methyl ester IUPAC Name: 5-O-(4,4-diphenylpiperidin-1-yl) 3-O-methyl (4S)-2,6-dimethyl-4-(3-nitrophenyl)-1-propyl-4H-pyridine-3,5-dicarboxylate Traditional Name: (4S)-2,6-dimethyl-4-(3-nitrophenyl)-1-propyl-4H-pyridine-3,5-dicarboxylic acid O5-(4,4-diphenylpiperidino) ester O3-methyl ester Formula: C36H39N3O6 MolecularWeight: 609.71136

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(C(=C1C)C(=O)ON2CCC(CC2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)OC)C

Isomeric SMILES

CCCN1C(=C([C@@H](C(=C1C)C(=O)ON2CCC(CC2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)OC)C

InChI

InChI=1S/C36H39N3O6/c1-5-21-38-25(2)31(34(40)44-4)33(27-13-12-18-30(24-27)39(42)43)32(26(38)3)35(41)45-37-22-19-36(20-23-37,28-14-8-6-9-15-28)29-16-10-7-11-17-29/h6-18,24,33H,5,19-23H2,1-4H3/t33-/m0/s1