[(E)-but-2-enyl] (4S,5R)-4-(3-ethoxyphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: [(E)-but-2-enyl] (4S,5R)-4-(3-ethoxyphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: [(E)-but-2-enyl] (4S,5R)-4-(3-ethoxyphenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R)-4-(3-ethoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid [(E)-but-2-enyl] ester IUPAC Name: [(E)-but-2-enyl] (4S,5R)-4-(3-ethoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (5R,6S)-2-keto-4-methylene-6-m-phenetyl-hexahydropyrimidine-5-carboxylic acid [(E)-but-2-enyl] ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2C(C(=C)NC(=O)N2)C(=O)OCC=CC

Isomeric SMILES

CCOC1=CC=CC(=C1)[C@@H]2[C@H](C(=C)NC(=O)N2)C(=O)OC/C=C/C

InChI

InChI=1S/C18H22N2O4/c1-4-6-10-24-17(21)15-12(3)19-18(22)20-16(15)13-8-7-9-14(11-13)23-5-2/h4,6-9,11,15-16H,3,5,10H2,1-2H3,(H2,19,20,22)/b6-4+/t15-,16+/m0/s1