2,6-dimethyl-5-[3-[(3-naphthalen-1-yloxy-2-oxidanyl-propyl)amino]propoxycarbonyl]-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: 2,6-dimethyl-5-[3-[(3-naphthalen-1-yloxy-2-oxidanyl-propyl)amino]propoxycarbonyl]-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: 5-[3-[[2-hydroxy-3-(1-naphthyloxy)propyl]amino]propoxycarbonyl]-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-[3-[[2-hydroxy-3-(1-naphthalenyloxy)propyl]amino]propoxy-oxomethyl]-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate IUPAC Name: 5-[3-[(2-hydroxy-3-naphthalen-1-yloxypropyl)amino]propoxycarbonyl]-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-[3-[[2-hydroxy-3-(1-naphthoxy)propyl]amino]propoxycarbonyl]-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Formula: C31H32N3O8- MolecularWeight: 574.60108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCCCNCC(COC2=CC=CC3=CC=CC=C32)O)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCCCNCC(COC2=CC=CC3=CC=CC=C32)O)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C31H33N3O8/c1-19-27(30(36)37)29(22-10-5-11-23(16-22)34(39)40)28(20(2)33-19)31(38)41-15-7-14-32-17-24(35)18-42-26-13-6-9-21-8-3-4-12-25(21)26/h3-6,8-13,16,24,29,32-33,35H,7,14-15,17-18H2,1-2H3,(H,36,37)/p-1