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

Systemtic Name: O5-methyl O3-[5-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenoxy]pentyl] 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate Openeye Name: O3-[5-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenoxy]pentyl] 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-[5-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenoxy]pentyl] ester O5-methyl ester IUPAC Name: 3-O-[5-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenoxy]pentyl] 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-[5-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenoxy]pentyl] ester O5-methyl ester Formula: C33H42N4O9 MolecularWeight: 638.70798

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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)OCCCCCOC3=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)OCCCCCOC3=CC=C(C=C3)OCC(CNC(C)C)O)C(=O)OC

InChI

InChI=1S/C33H42N4O9/c1-22(2)35-20-26(38)21-46-28-14-12-27(13-15-28)44-16-6-5-7-17-45-32(40)33(24-8-10-25(11-9-24)37(41)42)18-29(31(39)43-4)23(3)36-30(33)19-34/h8-15,22,26,30,35-36,38H,5-7,16-18,20-21H2,1-4H3