2-[4-[(2-tert-butyl-6-methoxy-quinolin-8-yl)amino]pentylamino]propanoic acid

Systemtic Name: 2-[4-[(2-tert-butyl-6-methoxy-quinolin-8-yl)amino]pentylamino]propanoic acid Openeye Name: 2-[4-[(2-tert-butyl-6-methoxy-8-quinolyl)amino]pentylamino]propanoic acid CAS Name: 2-[4-[(2-tert-butyl-6-methoxy-8-quinolinyl)amino]pentylamino]propanoic acid IUPAC Name: 2-[4-[(2-tert-butyl-6-methoxyquinolin-8-yl)amino]pentylamino]propanoic acid Traditional Name: 2-[4-[(2-tert-butyl-6-methoxy-8-quinolyl)amino]pentylamino]propionic acid Formula: C22H33N3O3 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCNC(C)C(=O)O)NC1=C2C(=CC(=C1)OC)C=CC(=N2)C(C)(C)C

Isomeric SMILES

CC(CCCNC(C)C(=O)O)NC1=C2C(=CC(=C1)OC)C=CC(=N2)C(C)(C)C

InChI

InChI=1S/C22H33N3O3/c1-14(8-7-11-23-15(2)21(26)27)24-18-13-17(28-6)12-16-9-10-19(22(3,4)5)25-20(16)18/h9-10,12-15,23-24H,7-8,11H2,1-6H3,(H,26,27)