4-[1-(4,4-dimethyl-1-propan-2-yl-2,3-dihydroquinolin-7-yl)ethylamino]benzoic acid

Systemtic Name: 4-[1-(4,4-dimethyl-1-propan-2-yl-2,3-dihydroquinolin-7-yl)ethylamino]benzoic acid Openeye Name: 4-[1-(1-isopropyl-4,4-dimethyl-2,3-dihydroquinolin-7-yl)ethylamino]benzoic acid CAS Name: 4-[1-(4,4-dimethyl-1-propan-2-yl-2,3-dihydroquinolin-7-yl)ethylamino]benzoic acid IUPAC Name: 4-[1-(4,4-dimethyl-1-propan-2-yl-2,3-dihydroquinolin-7-yl)ethylamino]benzoic acid Traditional Name: 4-[1-(1-isopropyl-4,4-dimethyl-2,3-dihydroquinolin-7-yl)ethylamino]benzoic acid Formula: C23H30N2O2 MolecularWeight: 366.4965

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(C2=C1C=C(C=C2)C(C)NC3=CC=C(C=C3)C(=O)O)(C)C

Isomeric SMILES

CC(C)N1CCC(C2=C1C=C(C=C2)C(C)NC3=CC=C(C=C3)C(=O)O)(C)C

InChI

InChI=1S/C23H30N2O2/c1-15(2)25-13-12-23(4,5)20-11-8-18(14-21(20)25)16(3)24-19-9-6-17(7-10-19)22(26)27/h6-11,14-16,24H,12-13H2,1-5H3,(H,26,27)