(4S,5R)-5-(4-chlorophenyl)carbonyl-4-(4-ethoxy-3-methoxy-phenyl)-6-methylidene-1,3-diazinan-2-one

Systemtic Name: (4S,5R)-5-(4-chlorophenyl)carbonyl-4-(4-ethoxy-3-methoxy-phenyl)-6-methylidene-1,3-diazinan-2-one Openeye Name: (4S,5R)-5-(4-chlorobenzoyl)-4-(4-ethoxy-3-methoxy-phenyl)-6-methylene-hexahydropyrimidin-2-one CAS Name: (4S,5R)-5-[(4-chlorophenyl)-oxomethyl]-4-(4-ethoxy-3-methoxyphenyl)-6-methylene-1,3-diazinan-2-one IUPAC Name: (4S,5R)-5-(4-chlorobenzoyl)-4-(4-ethoxy-3-methoxyphenyl)-6-methylidene-1,3-diazinan-2-one Traditional Name: (4S,5R)-5-(4-chlorobenzoyl)-4-(4-ethoxy-3-methoxy-phenyl)-6-methylene-hexahydropyrimidin-2-one Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2C(C(=C)NC(=O)N2)C(=O)C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@@H]2[C@H](C(=C)NC(=O)N2)C(=O)C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C21H21ClN2O4/c1-4-28-16-10-7-14(11-17(16)27-3)19-18(12(2)23-21(26)24-19)20(25)13-5-8-15(22)9-6-13/h5-11,18-19H,2,4H2,1,3H3,(H2,23,24,26)/t18-,19+/m0/s1