2-[2,2-dimethyl-1-(4-methylphenyl)carbonyl-3,4-dihydroquinolin-6-yl]propanoic acid

Systemtic Name: 2-[2,2-dimethyl-1-(4-methylphenyl)carbonyl-3,4-dihydroquinolin-6-yl]propanoic acid Openeye Name: 2-[2,2-dimethyl-1-(4-methylbenzoyl)-3,4-dihydroquinolin-6-yl]propanoic acid CAS Name: 2-[2,2-dimethyl-1-[(4-methylphenyl)-oxomethyl]-3,4-dihydroquinolin-6-yl]propanoic acid IUPAC Name: 2-[2,2-dimethyl-1-(4-methylbenzoyl)-3,4-dihydroquinolin-6-yl]propanoic acid Traditional Name: 2-(2,2-dimethyl-1-p-toluoyl-3,4-dihydroquinolin-6-yl)propionic acid Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C3=C(CCC2(C)C)C=C(C=C3)C(C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C3=C(CCC2(C)C)C=C(C=C3)C(C)C(=O)O

InChI

InChI=1S/C22H25NO3/c1-14-5-7-16(8-6-14)20(24)23-19-10-9-17(15(2)21(25)26)13-18(19)11-12-22(23,3)4/h5-10,13,15H,11-12H2,1-4H3,(H,25,26)