methyl 5-[3-(4,4-diphenylpiperidin-1-yl)propylcarbamoyl]-6-ethyl-2-methyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 5-[3-(4,4-diphenylpiperidin-1-yl)propylcarbamoyl]-6-ethyl-2-methyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-[3-(4,4-diphenyl-1-piperidyl)propylcarbamoyl]-6-ethyl-2-methyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-[[3-(4,4-diphenyl-1-piperidinyl)propylamino]-oxomethyl]-6-ethyl-2-methyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[3-(4,4-diphenylpiperidin-1-yl)propylcarbamoyl]-6-ethyl-2-methyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-[3-(4,4-diphenylpiperidino)propylcarbamoyl]-6-ethyl-2-methyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C37H42N4O5 MolecularWeight: 622.75318

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NCCCN3CCC(CC3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NCCCN3CCC(CC3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C37H42N4O5/c1-4-31-34(33(32(26(2)39-31)36(43)46-3)27-16-18-30(19-17-27)41(44)45)35(42)38-22-11-23-40-24-20-37(21-25-40,28-12-7-5-8-13-28)29-14-9-6-10-15-29/h5-10,12-19,33,39H,4,11,20-25H2,1-3H3,(H,38,42)