hexyl 4-[[(8-oxidanylquinolin-7-yl)-phenyl-methyl]amino]benzoate

Systemtic Name: hexyl 4-[[(8-oxidanylquinolin-7-yl)-phenyl-methyl]amino]benzoate Openeye Name: hexyl 4-[[(8-hydroxy-7-quinolyl)-phenyl-methyl]amino]benzoate CAS Name: 4-[[(8-hydroxy-7-quinolinyl)-phenylmethyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[[(8-hydroxyquinolin-7-yl)-phenylmethyl]amino]benzoate Traditional Name: 4-[[(8-hydroxy-7-quinolyl)-phenyl-methyl]amino]benzoic acid hexyl ester Formula: C29H30N2O3 MolecularWeight: 454.5601

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H30N2O3/c1-2-3-4-8-20-34-29(33)23-13-16-24(17-14-23)31-26(21-10-6-5-7-11-21)25-18-15-22-12-9-19-30-27(22)28(25)32/h5-7,9-19,26,31-32H,2-4,8,20H2,1H3