6-cyano-8-ethyl-4-[(4-methoxyphenyl)methylamino]quinoline-3-carboxylic acid

Systemtic Name: 6-cyano-8-ethyl-4-[(4-methoxyphenyl)methylamino]quinoline-3-carboxylic acid Openeye Name: 6-cyano-8-ethyl-4-[(4-methoxyphenyl)methylamino]quinoline-3-carboxylic acid CAS Name: 6-cyano-8-ethyl-4-[(4-methoxyphenyl)methylamino]-3-quinolinecarboxylic acid IUPAC Name: 6-cyano-8-ethyl-4-[(4-methoxyphenyl)methylamino]quinoline-3-carboxylic acid Traditional Name: 6-cyano-8-ethyl-4-(p-anisylamino)quinoline-3-carboxylic acid Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC2=C(C(=CN=C12)C(=O)O)NCC3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CCC1=CC(=CC2=C(C(=CN=C12)C(=O)O)NCC3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C21H19N3O3/c1-3-15-8-14(10-22)9-17-19(15)24-12-18(21(25)26)20(17)23-11-13-4-6-16(27-2)7-5-13/h4-9,12H,3,11H2,1-2H3,(H,23,24)(H,25,26)