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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2)C(CCN3C(C)C)(C)C

Isomeric SMILES

CCN(C1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2)C(CCN3C(C)C)(C)C

InChI

InChI=1S/C23H30N2O2/c1-6-24(18-9-7-17(8-10-18)22(26)27)19-11-12-20-21(15-19)25(16(2)3)14-13-23(20,4)5/h7-12,15-16H,6,13-14H2,1-5H3,(H,26,27)