methyl 2-methoxy-3-[3-(4-methoxycarbonyl-4-phenyl-piperidin-1-yl)propylcarbamoyl]-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylate

Systemtic Name: methyl 2-methoxy-3-[3-(4-methoxycarbonyl-4-phenyl-piperidin-1-yl)propylcarbamoyl]-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylate Openeye Name: methyl 2-methoxy-3-[3-(4-methoxycarbonyl-4-phenyl-1-piperidyl)propylcarbamoyl]-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylate CAS Name: 2-methoxy-3-[[3-(4-methoxycarbonyl-4-phenyl-1-piperidinyl)propylamino]-oxomethyl]-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 2-methoxy-3-[3-(4-methoxycarbonyl-4-phenylpiperidin-1-yl)propylcarbamoyl]-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylate Traditional Name: 3-[3-(4-carbomethoxy-4-phenyl-piperidino)propylcarbamoyl]-2-methoxy-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C31H37N5O8 MolecularWeight: 607.65418

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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)C(=O)OC)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C31H37N5O8/c1-21-25(27(37)42-2)26(22-11-13-24(14-12-22)36(40)41)35(30(33-21)44-4)29(39)32-17-8-18-34-19-15-31(16-20-34,28(38)43-3)23-9-6-5-7-10-23/h5-7,9-14,26H,8,15-20H2,1-4H3,(H,32,39)