6-cyano-8-ethyl-4-[(4-propan-2-ylphenyl)methylamino]quinoline-3-carboxylic acid

Systemtic Name: 6-cyano-8-ethyl-4-[(4-propan-2-ylphenyl)methylamino]quinoline-3-carboxylic acid Openeye Name: 6-cyano-8-ethyl-4-[(4-isopropylphenyl)methylamino]quinoline-3-carboxylic acid CAS Name: 6-cyano-8-ethyl-4-[(4-propan-2-ylphenyl)methylamino]-3-quinolinecarboxylic acid IUPAC Name: 6-cyano-8-ethyl-4-[(4-propan-2-ylphenyl)methylamino]quinoline-3-carboxylic acid Traditional Name: 6-cyano-8-ethyl-4-[(4-isopropylbenzyl)amino]quinoline-3-carboxylic acid Formula: C23H23N3O2 MolecularWeight: 373.44762

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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)C(C)C)C#N

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O2/c1-4-17-9-16(11-24)10-19-21(17)26-13-20(23(27)28)22(19)25-12-15-5-7-18(8-6-15)14(2)3/h5-10,13-14H,4,12H2,1-3H3,(H,25,26)(H,27,28)