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

Systemtic Name: methyl 3-[1-(3-methoxycarbonyl-4-phenyl-piperidin-1-yl)pentyl]-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylate Openeye Name: methyl 3-[1-(3-methoxycarbonyl-4-phenyl-1-piperidyl)pentyl]-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylate CAS Name: 3-[1-(3-methoxycarbonyl-4-phenyl-1-piperidinyl)pentyl]-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[1-(3-methoxycarbonyl-4-phenylpiperidin-1-yl)pentyl]-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylate Traditional Name: 3-[1-(3-carbomethoxy-4-phenyl-piperidino)pentyl]-6-methyl-4-(4-nitrophenyl)-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C31H38N4O6 MolecularWeight: 562.65662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(N1CCC(C(C1)C(=O)OC)C2=CC=CC=C2)N3C=NC(=C(C3C4=CC=C(C=C4)[N+](=O)[O-])C(=O)OC)C

Isomeric SMILES

CCCCC(N1CCC(C(C1)C(=O)OC)C2=CC=CC=C2)N3C=NC(=C(C3C4=CC=C(C=C4)[N+](=O)[O-])C(=O)OC)C

InChI

InChI=1S/C31H38N4O6/c1-5-6-12-27(33-18-17-25(22-10-8-7-9-11-22)26(19-33)30(36)40-3)34-20-32-21(2)28(31(37)41-4)29(34)23-13-15-24(16-14-23)35(38)39/h7-11,13-16,20,25-27,29H,5-6,12,17-19H2,1-4H3