2-[8-(2,2-dimethylpropanoylamino)-1-heptyl-5,7-dimethyl-3,4-dihydro-2H-quinolin-6-yl]ethanoic acid

Systemtic Name: 2-[8-(2,2-dimethylpropanoylamino)-1-heptyl-5,7-dimethyl-3,4-dihydro-2H-quinolin-6-yl]ethanoic acid Openeye Name: 2-[8-(2,2-dimethylpropanoylamino)-1-heptyl-5,7-dimethyl-3,4-dihydro-2H-quinolin-6-yl]acetic acid CAS Name: 2-[8-[(2,2-dimethyl-1-oxopropyl)amino]-1-heptyl-5,7-dimethyl-3,4-dihydro-2H-quinolin-6-yl]acetic acid IUPAC Name: 2-[8-(2,2-dimethylpropanoylamino)-1-heptyl-5,7-dimethyl-3,4-dihydro-2H-quinolin-6-yl]acetic acid Traditional Name: 2-[1-heptyl-5,7-dimethyl-8-(pivaloylamino)-3,4-dihydro-2H-quinolin-6-yl]acetic acid Formula: C25H40N2O3 MolecularWeight: 416.5967

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1CCCC2=C(C(=C(C(=C21)NC(=O)C(C)(C)C)C)CC(=O)O)C

Isomeric SMILES

CCCCCCCN1CCCC2=C(C(=C(C(=C21)NC(=O)C(C)(C)C)C)CC(=O)O)C

InChI

InChI=1S/C25H40N2O3/c1-7-8-9-10-11-14-27-15-12-13-19-17(2)20(16-21(28)29)18(3)22(23(19)27)26-24(30)25(4,5)6/h7-16H2,1-6H3,(H,26,30)(H,28,29)