2-ethoxyethyl 3-[[(8-oxidanylquinolin-7-yl)-thiophen-2-yl-methyl]amino]benzoate

Systemtic Name: 2-ethoxyethyl 3-[[(8-oxidanylquinolin-7-yl)-thiophen-2-yl-methyl]amino]benzoate Openeye Name: 2-ethoxyethyl 3-[[(8-hydroxy-7-quinolyl)-(2-thienyl)methyl]amino]benzoate CAS Name: 3-[[(8-hydroxy-7-quinolinyl)-thiophen-2-ylmethyl]amino]benzoic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl 3-[[(8-hydroxyquinolin-7-yl)-thiophen-2-ylmethyl]amino]benzoate Traditional Name: 3-[[(8-hydroxy-7-quinolyl)-(2-thienyl)methyl]amino]benzoic acid 2-ethoxyethyl ester Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C1=CC(=CC=C1)NC(C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CS4

Isomeric SMILES

CCOCCOC(=O)C1=CC(=CC=C1)NC(C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CS4

InChI

InChI=1S/C25H24N2O4S/c1-2-30-13-14-31-25(29)18-6-3-8-19(16-18)27-23(21-9-5-15-32-21)20-11-10-17-7-4-12-26-22(17)24(20)28/h3-12,15-16,23,27-28H,2,13-14H2,1H3