methyl (4R)-2-azanyl-1-(4-chlorophenyl)-5-oxidanylidene-4-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: methyl (4R)-2-azanyl-1-(4-chlorophenyl)-5-oxidanylidene-4-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carboxylate Openeye Name: methyl (4R)-2-amino-1-(4-chlorophenyl)-5-oxo-4-(3-pyridyl)-4,6,7,8-tetrahydroquinoline-3-carboxylate CAS Name: (4R)-2-amino-1-(4-chlorophenyl)-5-oxo-4-(3-pyridinyl)-4,6,7,8-tetrahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (4R)-2-amino-1-(4-chlorophenyl)-5-oxo-4-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4R)-2-amino-1-(4-chlorophenyl)-5-keto-4-(3-pyridyl)-4,6,7,8-tetrahydroquinoline-3-carboxylic acid methyl ester Formula: C22H20ClN3O3 MolecularWeight: 409.8655

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C2=C(C1C3=CN=CC=C3)C(=O)CCC2)C4=CC=C(C=C4)Cl)N

Isomeric SMILES

COC(=O)C1=C(N(C2=C([C@H]1C3=CN=CC=C3)C(=O)CCC2)C4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C22H20ClN3O3/c1-29-22(28)20-18(13-4-3-11-25-12-13)19-16(5-2-6-17(19)27)26(21(20)24)15-9-7-14(23)8-10-15/h3-4,7-12,18H,2,5-6,24H2,1H3/t18-/m1/s1