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

Systemtic Name: [(E)-but-2-enyl] (4S,5R)-4-(2-butoxyphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: [(E)-but-2-enyl] (4S,5R)-4-(2-butoxyphenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R)-4-(2-butoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid [(E)-but-2-enyl] ester IUPAC Name: [(E)-but-2-enyl] (4S,5R)-4-(2-butoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4S,5R)-4-(2-butoxyphenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid [(E)-but-2-enyl] ester Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C2C(C(=C)NC(=O)N2)C(=O)OCC=CC

Isomeric SMILES

CCCCOC1=CC=CC=C1[C@@H]2[C@H](C(=C)NC(=O)N2)C(=O)OC/C=C/C

InChI

InChI=1S/C20H26N2O4/c1-4-6-12-25-16-11-9-8-10-15(16)18-17(14(3)21-20(24)22-18)19(23)26-13-7-5-2/h5,7-11,17-18H,3-4,6,12-13H2,1-2H3,(H2,21,22,24)/b7-5+/t17-,18+/m0/s1