methyl 1-[3-[[(4R)-5-aminocarbonyl-6-ethyl-4-(4-nitrophenyl)-2-oxidanylidene-1,4-dihydropyrimidin-3-yl]carbonylamino]propyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: methyl 1-[3-[[(4R)-5-aminocarbonyl-6-ethyl-4-(4-nitrophenyl)-2-oxidanylidene-1,4-dihydropyrimidin-3-yl]carbonylamino]propyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-[3-[[(4R)-5-carbamoyl-6-ethyl-4-(4-nitrophenyl)-2-oxo-1,4-dihydropyrimidine-3-carbonyl]amino]propyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[3-[[[(4R)-5-carbamoyl-6-ethyl-4-(4-nitrophenyl)-2-oxo-1,4-dihydropyrimidin-3-yl]-oxomethyl]amino]propyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-[[(4R)-5-carbamoyl-6-ethyl-4-(4-nitrophenyl)-2-oxo-1,4-dihydropyrimidine-3-carbonyl]amino]propyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[3-[[(4R)-5-carbamoyl-6-ethyl-2-keto-4-(4-nitrophenyl)-1,4-dihydropyrimidine-3-carbonyl]amino]propyl]-4-phenyl-isonipecotic acid methyl ester Formula: C30H36N6O7 MolecularWeight: 592.64284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(N(C(=O)N1)C(=O)NCCCN2CCC(CC2)(C3=CC=CC=C3)C(=O)OC)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)N

Isomeric SMILES

CCC1=C([C@H](N(C(=O)N1)C(=O)NCCCN2CCC(CC2)(C3=CC=CC=C3)C(=O)OC)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C30H36N6O7/c1-3-23-24(26(31)37)25(20-10-12-22(13-11-20)36(41)42)35(29(40)33-23)28(39)32-16-7-17-34-18-14-30(15-19-34,27(38)43-2)21-8-5-4-6-9-21/h4-6,8-13,25H,3,7,14-19H2,1-2H3,(H2,31,37)(H,32,39)(H,33,40)/t25-/m1/s1