methyl 3-[[(E)-1-[(5R)-1-(4-chlorophenyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]prop-1-enyl]amino]benzoate

Systemtic Name: methyl 3-[[(E)-1-[(5R)-1-(4-chlorophenyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]prop-1-enyl]amino]benzoate Openeye Name: methyl 3-[[(E)-1-[(5R)-1-(4-chlorophenyl)-2,4,6-trioxo-hexahydropyrimidin-5-yl]prop-1-enyl]amino]benzoate CAS Name: 3-[[(E)-1-[(5R)-1-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-yl]prop-1-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[(E)-1-[(5R)-1-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-yl]prop-1-enyl]amino]benzoate Traditional Name: 3-[[(E)-1-[(5R)-1-(4-chlorophenyl)-2,4,6-triketo-hexahydropyrimidin-5-yl]prop-1-enyl]amino]benzoic acid methyl ester Formula: C21H18ClN3O5 MolecularWeight: 427.83772

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)Cl)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

C/C=C(\[C@@H]1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)Cl)/NC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C21H18ClN3O5/c1-3-16(23-14-6-4-5-12(11-14)20(28)30-2)17-18(26)24-21(29)25(19(17)27)15-9-7-13(22)8-10-15/h3-11,17,23H,1-2H3,(H,24,26,29)/b16-3+/t17-/m1/s1