dimethyl 2-[[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-8-ethyl-quinolin-3-yl]methyl]propanedioate

Systemtic Name: dimethyl 2-[[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-8-ethyl-quinolin-3-yl]methyl]propanedioate Openeye Name: dimethyl 2-[[4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-8-ethyl-3-quinolyl]methyl]propanedioate CAS Name: 2-[[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-8-ethyl-3-quinolinyl]methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-8-ethylquinolin-3-yl]methyl]propanedioate Traditional Name: 2-[[4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-8-ethyl-3-quinolyl]methyl]malonic acid dimethyl ester Formula: C26H26ClN3O5 MolecularWeight: 495.95474

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC2=C(C(=CN=C12)CC(C(=O)OC)C(=O)OC)NCC3=CC(=C(C=C3)OC)Cl)C#N

Isomeric SMILES

CCC1=CC(=CC2=C(C(=CN=C12)CC(C(=O)OC)C(=O)OC)NCC3=CC(=C(C=C3)OC)Cl)C#N

InChI

InChI=1S/C26H26ClN3O5/c1-5-17-8-16(12-28)9-19-23(17)30-14-18(11-20(25(31)34-3)26(32)35-4)24(19)29-13-15-6-7-22(33-2)21(27)10-15/h6-10,14,20H,5,11,13H2,1-4H3,(H,29,30)