ethyl 4-[(2-ethylphenyl)amino]-8-methoxy-quinoline-3-carboxylate phosphate

Systemtic Name: ethyl 4-[(2-ethylphenyl)amino]-8-methoxy-quinoline-3-carboxylate phosphate Openeye Name: ethyl 4-(2-ethylanilino)-8-methoxy-quinoline-3-carboxylate phosphate CAS Name: 4-(2-ethylanilino)-8-methoxy-3-quinolinecarboxylic acid ethyl ester phosphate IUPAC Name: ethyl 4-(2-ethylanilino)-8-methoxyquinoline-3-carboxylate phosphate Traditional Name: 4-(2-ethylanilino)-8-methoxy-quinoline-3-carboxylic acid ethyl ester phosphate Formula: C21H22N2O7P-3 MolecularWeight: 445.382341

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C3C=CC=C(C3=NC=C2C(=O)OCC)OC.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC2=C3C=CC=C(C3=NC=C2C(=O)OCC)OC.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C21H22N2O3.H3O4P/c1-4-14-9-6-7-11-17(14)23-19-15-10-8-12-18(25-3)20(15)22-13-16(19)21(24)26-5-2;1-5(2,3)4/h6-13H,4-5H2,1-3H3,(H,22,23);(H3,1,2,3,4)/p-3