ethyl (4R)-4-(2-methoxyphenyl)-6-(morpholin-4-ium-4-ylmethyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R)-4-(2-methoxyphenyl)-6-(morpholin-4-ium-4-ylmethyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-4-(2-methoxyphenyl)-6-(morpholin-4-ium-4-ylmethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-(2-methoxyphenyl)-6-(4-morpholin-4-iumylmethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-4-(2-methoxyphenyl)-6-(morpholin-4-ium-4-ylmethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-2-keto-4-(2-methoxyphenyl)-6-(morpholin-4-ium-4-ylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H26N3O5+ MolecularWeight: 376.42684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2OC)C[NH+]3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C2=CC=CC=C2OC)C[NH+]3CCOCC3

InChI

InChI=1S/C19H25N3O5/c1-3-27-18(23)16-14(12-22-8-10-26-11-9-22)20-19(24)21-17(16)13-6-4-5-7-15(13)25-2/h4-7,17H,3,8-12H2,1-2H3,(H2,20,21,24)/p+1/t17-/m1/s1