(4S,5R)-4-(4-butoxy-3-ethoxy-phenyl)-5-ethanoyl-6-methylidene-1,3-diazinan-2-one

Systemtic Name: (4S,5R)-4-(4-butoxy-3-ethoxy-phenyl)-5-ethanoyl-6-methylidene-1,3-diazinan-2-one Openeye Name: (4S,5R)-5-acetyl-4-(4-butoxy-3-ethoxy-phenyl)-6-methylene-hexahydropyrimidin-2-one CAS Name: (4S,5R)-5-acetyl-4-(4-butoxy-3-ethoxyphenyl)-6-methylene-1,3-diazinan-2-one IUPAC Name: (4S,5R)-5-acetyl-4-(4-butoxy-3-ethoxyphenyl)-6-methylidene-1,3-diazinan-2-one Traditional Name: (4S,5R)-5-acetyl-4-(4-butoxy-3-ethoxy-phenyl)-6-methylene-hexahydropyrimidin-2-one Formula: C19H26N2O4 MolecularWeight: 346.42074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(C(=C)NC(=O)N2)C(=O)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)[C@@H]2[C@H](C(=C)NC(=O)N2)C(=O)C)OCC

InChI

InChI=1S/C19H26N2O4/c1-5-7-10-25-15-9-8-14(11-16(15)24-6-2)18-17(13(4)22)12(3)20-19(23)21-18/h8-9,11,17-18H,3,5-7,10H2,1-2,4H3,(H2,20,21,23)/t17-,18-/m1/s1