6-[(E)-2-[4-(3,5-dimethylphenyl)-2-methyl-quinolin-3-yl]ethenyl]oxan-2-one

Systemtic Name: 6-[(E)-2-[4-(3,5-dimethylphenyl)-2-methyl-quinolin-3-yl]ethenyl]oxan-2-one Openeye Name: 6-[(E)-2-[4-(3,5-dimethylphenyl)-2-methyl-3-quinolyl]vinyl]tetrahydropyran-2-one CAS Name: 6-[(E)-2-[4-(3,5-dimethylphenyl)-2-methyl-3-quinolinyl]ethenyl]-2-oxanone IUPAC Name: 6-[(E)-2-[4-(3,5-dimethylphenyl)-2-methylquinolin-3-yl]ethenyl]oxan-2-one Traditional Name: 6-[(E)-2-[4-(3,5-dimethylphenyl)-2-methyl-3-quinolyl]vinyl]tetrahydropyran-2-one Formula: C25H25NO2 MolecularWeight: 371.4715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C(C(=NC3=CC=CC=C32)C)C=CC4CCCC(=O)O4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C(=NC3=CC=CC=C32)C)/C=C/C4CCCC(=O)O4)C

InChI

InChI=1S/C25H25NO2/c1-16-13-17(2)15-19(14-16)25-21(12-11-20-7-6-10-24(27)28-20)18(3)26-23-9-5-4-8-22(23)25/h4-5,8-9,11-15,20H,6-7,10H2,1-3H3/b12-11+