propyl (5S,6S)-4-methylidene-2-oxidanylidene-6-(2-propoxyphenyl)-1,3-diazinane-5-carboxylate

Systemtic Name: propyl (5S,6S)-4-methylidene-2-oxidanylidene-6-(2-propoxyphenyl)-1,3-diazinane-5-carboxylate Openeye Name: propyl (5S,6S)-4-methylene-2-oxo-6-(2-propoxyphenyl)hexahydropyrimidine-5-carboxylate CAS Name: (5S,6S)-4-methylene-2-oxo-6-(2-propoxyphenyl)-1,3-diazinane-5-carboxylic acid propyl ester IUPAC Name: propyl (5S,6S)-4-methylidene-2-oxo-6-(2-propoxyphenyl)-1,3-diazinane-5-carboxylate Traditional Name: (5S,6S)-2-keto-4-methylene-6-(2-propoxyphenyl)hexahydropyrimidine-5-carboxylic acid propyl ester Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2C(C(=C)NC(=O)N2)C(=O)OCCC

Isomeric SMILES

CCCOC1=CC=CC=C1[C@@H]2[C@@H](C(=C)NC(=O)N2)C(=O)OCCC

InChI

InChI=1S/C18H24N2O4/c1-4-10-23-14-9-7-6-8-13(14)16-15(17(21)24-11-5-2)12(3)19-18(22)20-16/h6-9,15-16H,3-5,10-11H2,1-2H3,(H2,19,20,22)/t15-,16-/m1/s1