4-[(3-carboxyphenyl)amino]-8-morpholin-4-yl-quinoline-3-carboxylic acid

Systemtic Name: 4-[(3-carboxyphenyl)amino]-8-morpholin-4-yl-quinoline-3-carboxylic acid Openeye Name: 4-(3-carboxyanilino)-8-morpholino-quinoline-3-carboxylic acid CAS Name: 4-(3-carboxyanilino)-8-(4-morpholinyl)-3-quinolinecarboxylic acid IUPAC Name: 4-(3-carboxyanilino)-8-morpholin-4-ylquinoline-3-carboxylic acid Traditional Name: 4-(3-carboxyanilino)-8-morpholino-quinoline-3-carboxylic acid Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=CC3=C(C(=CN=C32)C(=O)O)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1COCCN1C2=CC=CC3=C(C(=CN=C32)C(=O)O)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C21H19N3O5/c25-20(26)13-3-1-4-14(11-13)23-18-15-5-2-6-17(24-7-9-29-10-8-24)19(15)22-12-16(18)21(27)28/h1-6,11-12H,7-10H2,(H,22,23)(H,25,26)(H,27,28)