2-[[4-[5-(diethylamino)pentan-2-ylamino]quinolin-7-yl]amino]benzoic acid

Systemtic Name: 2-[[4-[5-(diethylamino)pentan-2-ylamino]quinolin-7-yl]amino]benzoic acid Openeye Name: 2-[[4-[[4-(diethylamino)-1-methyl-butyl]amino]-7-quinolyl]amino]benzoic acid CAS Name: 2-[[4-[5-(diethylamino)pentan-2-ylamino]-7-quinolinyl]amino]benzoic acid IUPAC Name: 2-[[4-[5-(diethylamino)pentan-2-ylamino]quinolin-7-yl]amino]benzoic acid Traditional Name: 2-[[4-[[4-(diethylamino)-1-methyl-butyl]amino]-7-quinolyl]amino]benzoic acid Formula: C25H32N4O2 MolecularWeight: 420.54718

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C25H32N4O2/c1-4-29(5-2)16-8-9-18(3)27-23-14-15-26-24-17-19(12-13-20(23)24)28-22-11-7-6-10-21(22)25(30)31/h6-7,10-15,17-18,28H,4-5,8-9,16H2,1-3H3,(H,26,27)(H,30,31)