O5-nonyl O3-(2-oxidanylidene-2-piperazin-1-yl-ethyl) 4-[2,6-bis(chloranyl)phenyl]-2-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-nonyl O3-(2-oxidanylidene-2-piperazin-1-yl-ethyl) 4-[2,6-bis(chloranyl)phenyl]-2-methyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-nonyl O3-(2-oxo-2-piperazin-1-yl-ethyl) 4-(2,6-dichlorophenyl)-2-methyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2,6-dichlorophenyl)-2-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-nonyl ester O3-[2-oxo-2-(1-piperazinyl)ethyl] ester IUPAC Name: 5-O-nonyl 3-O-(2-oxo-2-piperazin-1-ylethyl) 4-(2,6-dichlorophenyl)-2-methyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2,6-dichlorophenyl)-2-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-(2-keto-2-piperazino-ethyl) ester O5-nonyl ester Formula: C29H39Cl2N3O5 MolecularWeight: 580.54306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC(=O)C1=CNC(=C(C1C2=C(C=CC=C2Cl)Cl)C(=O)OCC(=O)N3CCNCC3)C

Isomeric SMILES

CCCCCCCCCOC(=O)C1=CNC(=C(C1C2=C(C=CC=C2Cl)Cl)C(=O)OCC(=O)N3CCNCC3)C

InChI

InChI=1S/C29H39Cl2N3O5/c1-3-4-5-6-7-8-9-17-38-28(36)21-18-33-20(2)25(26(21)27-22(30)11-10-12-23(27)31)29(37)39-19-24(35)34-15-13-32-14-16-34/h10-12,18,26,32-33H,3-9,13-17,19H2,1-2H3