2-azanyl-5-cyclohexyl-3-[1-(diphenylmethyl)azetidin-3-yl]-6-methyl-4-(3-nitrophenyl)piperidine-3,5-dicarboxylic acid

Systemtic Name: 2-azanyl-5-cyclohexyl-3-[1-(diphenylmethyl)azetidin-3-yl]-6-methyl-4-(3-nitrophenyl)piperidine-3,5-dicarboxylic acid Openeye Name: 2-amino-3-(1-benzhydrylazetidin-3-yl)-5-cyclohexyl-6-methyl-4-(3-nitrophenyl)piperidine-3,5-dicarboxylic acid CAS Name: 2-amino-5-cyclohexyl-3-[1-(diphenylmethyl)-3-azetidinyl]-6-methyl-4-(3-nitrophenyl)piperidine-3,5-dicarboxylic acid IUPAC Name: 2-amino-3-(1-benzhydrylazetidin-3-yl)-5-cyclohexyl-6-methyl-4-(3-nitrophenyl)piperidine-3,5-dicarboxylic acid Traditional Name: 2-amino-3-(1-benzhydrylazetidin-3-yl)-5-cyclohexyl-6-methyl-4-(3-nitrophenyl)piperidine-3,5-dicarboxylic acid Formula: C36H42N4O6 MolecularWeight: 626.74188

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(N1)N)(C2CN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O)C5=CC(=CC=C5)[N+](=O)[O-])(C6CCCCC6)C(=O)O

Isomeric SMILES

CC1C(C(C(C(N1)N)(C2CN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O)C5=CC(=CC=C5)[N+](=O)[O-])(C6CCCCC6)C(=O)O

InChI

InChI=1S/C36H42N4O6/c1-23-35(33(41)42,27-17-9-4-10-18-27)31(26-16-11-19-29(20-26)40(45)46)36(34(43)44,32(37)38-23)28-21-39(22-28)30(24-12-5-2-6-13-24)25-14-7-3-8-15-25/h2-3,5-8,11-16,19-20,23,27-28,30-32,38H,4,9-10,17-18,21-22,37H2,1H3,(H,41,42)(H,43,44)