ethyl (4R,5S)-4-(3-nitrophenyl)-6-oxidanylidene-2-piperidin-1-yl-4,5-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R,5S)-4-(3-nitrophenyl)-6-oxidanylidene-2-piperidin-1-yl-4,5-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R,5S)-4-(3-nitrophenyl)-6-oxo-2-(1-piperidyl)-4,5-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R,5S)-4-(3-nitrophenyl)-6-oxo-2-(1-piperidinyl)-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R,5S)-4-(3-nitrophenyl)-6-oxo-2-piperidin-1-yl-4,5-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R,5S)-6-keto-4-(3-nitrophenyl)-2-piperidino-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H22N4O5 MolecularWeight: 374.39108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N=C(NC1=O)N2CCCCC2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](N=C(NC1=O)N2CCCCC2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O5/c1-2-27-17(24)14-15(12-7-6-8-13(11-12)22(25)26)19-18(20-16(14)23)21-9-4-3-5-10-21/h6-8,11,14-15H,2-5,9-10H2,1H3,(H,19,20,23)/t14-,15-/m0/s1