ethyl 4-(1,3-benzodioxol-5-yl)-2-oxidanylidene-6-propylidene-1,3-diazinane-5-carboxylate

Systemtic Name: ethyl 4-(1,3-benzodioxol-5-yl)-2-oxidanylidene-6-propylidene-1,3-diazinane-5-carboxylate Openeye Name: ethyl 4-(1,3-benzodioxol-5-yl)-2-oxo-6-propylidene-hexahydropyrimidine-5-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-2-oxo-6-propylidene-1,3-diazinane-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxol-5-yl)-2-oxo-6-propylidene-1,3-diazinane-5-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-keto-6-propylidene-hexahydropyrimidine-5-carboxylic acid ethyl ester Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C1C(C(NC(=O)N1)C2=CC3=C(C=C2)OCO3)C(=O)OCC

Isomeric SMILES

CCC=C1C(C(NC(=O)N1)C2=CC3=C(C=C2)OCO3)C(=O)OCC

InChI

InChI=1S/C17H20N2O5/c1-3-5-11-14(16(20)22-4-2)15(19-17(21)18-11)10-6-7-12-13(8-10)24-9-23-12/h5-8,14-15H,3-4,9H2,1-2H3,(H2,18,19,21)