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

Systemtic Name: [(E)-but-2-enyl] (4S,5R)-4-(1,3-benzodioxol-5-yl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: [(E)-but-2-enyl] (4S,5R)-4-(1,3-benzodioxol-5-yl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R)-4-(1,3-benzodioxol-5-yl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid [(E)-but-2-enyl] ester IUPAC Name: [(E)-but-2-enyl] (4S,5R)-4-(1,3-benzodioxol-5-yl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4S,5R)-4-(1,3-benzodioxol-5-yl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid [(E)-but-2-enyl] ester Formula: C17H18N2O5 MolecularWeight: 330.33522

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCOC(=O)C1C(NC(=O)NC1=C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C=C/COC(=O)[C@@H]1[C@H](NC(=O)NC1=C)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H18N2O5/c1-3-4-7-22-16(20)14-10(2)18-17(21)19-15(14)11-5-6-12-13(8-11)24-9-23-12/h3-6,8,14-15H,2,7,9H2,1H3,(H2,18,19,21)/b4-3+/t14-,15+/m0/s1