methyl 3-[[(S)-(8-oxidanylquinolin-7-yl)-pyridin-2-yl-methyl]amino]benzoate

Systemtic Name: methyl 3-[[(S)-(8-oxidanylquinolin-7-yl)-pyridin-2-yl-methyl]amino]benzoate Openeye Name: methyl 3-[[(S)-(8-hydroxy-7-quinolyl)-(2-pyridyl)methyl]amino]benzoate CAS Name: 3-[[(S)-(8-hydroxy-7-quinolinyl)-(2-pyridinyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[(S)-(8-hydroxyquinolin-7-yl)-pyridin-2-ylmethyl]amino]benzoate Traditional Name: 3-[[(S)-(8-hydroxy-7-quinolyl)-(2-pyridyl)methyl]amino]benzoic acid methyl ester Formula: C23H19N3O3 MolecularWeight: 385.41526

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CC=N4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)N[C@@H](C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CC=N4

InChI

InChI=1S/C23H19N3O3/c1-29-23(28)16-6-4-8-17(14-16)26-21(19-9-2-3-12-24-19)18-11-10-15-7-5-13-25-20(15)22(18)27/h2-14,21,26-27H,1H3/t21-/m0/s1