4-[(3,4-dimethoxyphenyl)amino]-8-morpholin-4-yl-quinoline-3-carboxylate

Systemtic Name: 4-[(3,4-dimethoxyphenyl)amino]-8-morpholin-4-yl-quinoline-3-carboxylate Openeye Name: 4-(3,4-dimethoxyanilino)-8-morpholino-quinoline-3-carboxylate CAS Name: 4-(3,4-dimethoxyanilino)-8-(4-morpholinyl)-3-quinolinecarboxylate IUPAC Name: 4-(3,4-dimethoxyanilino)-8-morpholin-4-ylquinoline-3-carboxylate Traditional Name: 4-(3,4-dimethoxyanilino)-8-morpholino-quinoline-3-carboxylate Formula: C22H22N3O5- MolecularWeight: 408.42718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=C3C=CC=C(C3=NC=C2C(=O)[O-])N4CCOCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=C3C=CC=C(C3=NC=C2C(=O)[O-])N4CCOCC4)OC

InChI

InChI=1S/C22H23N3O5/c1-28-18-7-6-14(12-19(18)29-2)24-20-15-4-3-5-17(25-8-10-30-11-9-25)21(15)23-13-16(20)22(26)27/h3-7,12-13H,8-11H2,1-2H3,(H,23,24)(H,26,27)/p-1