O5-butyl O3-methyl 4-[3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylcarbamoylamino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-butyl O3-methyl 4-[3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylcarbamoylamino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-butyl O3-methyl 4-[3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylcarbamoylamino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-[3-[[[3-[4-(2-methoxyphenyl)-1-piperazinyl]propylamino]-oxomethyl]amino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-butyl ester O3-methyl ester IUPAC Name: 5-O-butyl 3-O-methyl 4-[3-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylcarbamoylamino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-[3-[3-[4-(2-methoxyphenyl)piperazino]propylcarbamoylamino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-butyl ester O3-methyl ester Formula: C35H47N5O6 MolecularWeight: 633.77758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)NC(=O)NCCCN3CCN(CC3)C4=CC=CC=C4OC)C(=O)OC)C)C

Isomeric SMILES

CCCCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)NC(=O)NCCCN3CCN(CC3)C4=CC=CC=C4OC)C(=O)OC)C)C

InChI

InChI=1S/C35H47N5O6/c1-6-7-22-46-34(42)31-25(3)37-24(2)30(33(41)45-5)32(31)26-12-10-13-27(23-26)38-35(43)36-16-11-17-39-18-20-40(21-19-39)28-14-8-9-15-29(28)44-4/h8-10,12-15,23,32,37H,6-7,11,16-22H2,1-5H3,(H2,36,38,43)