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

Systemtic Name: O3-[2-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenoxy]ethyl] O5-methyl 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate Openeye Name: O3-[2-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]phenoxy]ethyl] 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-[2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenoxy]ethyl] ester O5-methyl ester IUPAC Name: 3-O-[2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenoxy]ethyl] 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-[2-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]phenoxy]ethyl] 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)OCCOC3=CC=C(C=C3)OCC(CNC(C)(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)OCCOC3=CC=C(C=C3)OCC(CNC(C)(C)C)O)C(=O)OC

InChI

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