O5-methyl O3-[3-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenoxy]propyl] 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate

Systemtic Name: O5-methyl O3-[3-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenoxy]propyl] 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate Openeye Name: O3-[3-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenoxy]propyl] O5-methyl 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate CAS Name: 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid O3-[3-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenoxy]propyl] ester O5-methyl ester IUPAC Name: 3-O-[3-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenoxy]propyl] 5-O-methyl 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate Traditional Name: 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid O3-[3-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenoxy]propyl] ester O5-methyl ester Formula: C31H38N4O9 MolecularWeight: 610.65482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(N1)C#N)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCCOC3=CC=C(C=C3)OCC(CNC(C)C)O)C(=O)OC

Isomeric SMILES

CC1=C(CC(C(N1)C#N)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCCOC3=CC=C(C=C3)OCC(CNC(C)C)O)C(=O)OC

InChI

InChI=1S/C31H38N4O9/c1-20(2)33-18-24(36)19-44-26-12-10-25(11-13-26)42-14-5-15-43-30(38)31(22-6-8-23(9-7-22)35(39)40)16-27(29(37)41-4)21(3)34-28(31)17-32/h6-13,20,24,28,33-34,36H,5,14-16,18-19H2,1-4H3