ethyl 4-[[(S)-(8-oxidanylquinolin-7-yl)-pyridin-2-yl-methyl]amino]benzoate

Systemtic Name: ethyl 4-[[(S)-(8-oxidanylquinolin-7-yl)-pyridin-2-yl-methyl]amino]benzoate Openeye Name: ethyl 4-[[(S)-(8-hydroxy-7-quinolyl)-(2-pyridyl)methyl]amino]benzoate CAS Name: 4-[[(S)-(8-hydroxy-7-quinolinyl)-(2-pyridinyl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(S)-(8-hydroxyquinolin-7-yl)-pyridin-2-ylmethyl]amino]benzoate Traditional Name: 4-[[(S)-(8-hydroxy-7-quinolyl)-(2-pyridyl)methyl]amino]benzoic acid ethyl ester Formula: C24H21N3O3 MolecularWeight: 399.44184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21N3O3/c1-2-30-24(29)17-8-11-18(12-9-17)27-22(20-7-3-4-14-25-20)19-13-10-16-6-5-15-26-21(16)23(19)28/h3-15,22,27-28H,2H2,1H3/t22-/m0/s1