6-methyl-2-propan-2-yl-2-quinolin-3-yl-hept-6-enoic acid

Systemtic Name: 6-methyl-2-propan-2-yl-2-quinolin-3-yl-hept-6-enoic acid Openeye Name: 2-isopropyl-6-methyl-2-(3-quinolyl)hept-6-enoic acid CAS Name: 6-methyl-2-propan-2-yl-2-(3-quinolinyl)-6-heptenoic acid IUPAC Name: 6-methyl-2-propan-2-yl-2-quinolin-3-ylhept-6-enoic acid Traditional Name: 2-isopropyl-6-methyl-2-(3-quinolyl)hept-6-enoic acid Formula: C20H25NO2 MolecularWeight: 311.418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC(=C)C)(C1=CC2=CC=CC=C2N=C1)C(=O)O

Isomeric SMILES

CC(C)C(CCCC(=C)C)(C1=CC2=CC=CC=C2N=C1)C(=O)O

InChI

InChI=1S/C20H25NO2/c1-14(2)8-7-11-20(15(3)4,19(22)23)17-12-16-9-5-6-10-18(16)21-13-17/h5-6,9-10,12-13,15H,1,7-8,11H2,2-4H3,(H,22,23)