methyl 3-[3-(4,4-diphenylpiperidin-1-yl)propylcarbamoyl]-2-methoxy-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylate

Systemtic Name: methyl 3-[3-(4,4-diphenylpiperidin-1-yl)propylcarbamoyl]-2-methoxy-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylate Openeye Name: methyl 3-[3-(4,4-diphenyl-1-piperidyl)propylcarbamoyl]-2-methoxy-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylate CAS Name: 3-[[3-(4,4-diphenyl-1-piperidinyl)propylamino]-oxomethyl]-2-methoxy-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[3-(4,4-diphenylpiperidin-1-yl)propylcarbamoyl]-2-methoxy-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylate Traditional Name: 3-[3-(4,4-diphenylpiperidino)propylcarbamoyl]-2-methoxy-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C35H39N5O6 MolecularWeight: 625.71406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=N1)OC)C(=O)NCCCN2CCC(CC2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(N(C(=N1)OC)C(=O)NCCCN2CCC(CC2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C35H39N5O6/c1-25-30(32(41)45-2)31(26-15-17-29(18-16-26)40(43)44)39(34(37-25)46-3)33(42)36-21-10-22-38-23-19-35(20-24-38,27-11-6-4-7-12-27)28-13-8-5-9-14-28/h4-9,11-18,31H,10,19-24H2,1-3H3,(H,36,42)