2-ethoxyethyl 4-[[(2-methyl-8-oxidanyl-quinolin-7-yl)-thiophen-2-yl-methyl]amino]benzoate

Systemtic Name: 2-ethoxyethyl 4-[[(2-methyl-8-oxidanyl-quinolin-7-yl)-thiophen-2-yl-methyl]amino]benzoate Openeye Name: 2-ethoxyethyl 4-[[(8-hydroxy-2-methyl-7-quinolyl)-(2-thienyl)methyl]amino]benzoate CAS Name: 4-[[(8-hydroxy-2-methyl-7-quinolinyl)-thiophen-2-ylmethyl]amino]benzoic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl 4-[[(8-hydroxy-2-methylquinolin-7-yl)-thiophen-2-ylmethyl]amino]benzoate Traditional Name: 4-[[(8-hydroxy-2-methyl-7-quinolyl)-(2-thienyl)methyl]amino]benzoic acid 2-ethoxyethyl ester Formula: C26H26N2O4S MolecularWeight: 462.56064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26N2O4S/c1-3-31-14-15-32-26(30)19-8-11-20(12-9-19)28-24(22-5-4-16-33-22)21-13-10-18-7-6-17(2)27-23(18)25(21)29/h4-13,16,24,28-29H,3,14-15H2,1-2H3