ethyl (6R)-6-(4-hydroxyphenyl)-3-methyl-4-(morpholin-4-ium-4-ylmethyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=C(C=C2)O)C)C[NH+]3CCOCC3

Isomeric SMILES

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

InChI

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