7-chloranyl-3-(3,5-dimethylphenyl)-1-ethynyl-4-(2-piperidin-2-ylethoxy)quinolin-2-one

Systemtic Name: 7-chloranyl-3-(3,5-dimethylphenyl)-1-ethynyl-4-(2-piperidin-2-ylethoxy)quinolin-2-one Openeye Name: 7-chloro-3-(3,5-dimethylphenyl)-1-ethynyl-4-[2-(2-piperidyl)ethoxy]quinolin-2-one CAS Name: 7-chloro-3-(3,5-dimethylphenyl)-1-ethynyl-4-[2-(2-piperidinyl)ethoxy]-2-quinolinone IUPAC Name: 7-chloro-3-(3,5-dimethylphenyl)-1-ethynyl-4-(2-piperidin-2-ylethoxy)quinolin-2-one Traditional Name: 7-chloro-3-(3,5-dimethylphenyl)-1-ethynyl-4-[2-(2-piperidyl)ethoxy]carbostyril Formula: C26H27ClN2O2 MolecularWeight: 434.95778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C(C3=C(C=C(C=C3)Cl)N(C2=O)C#C)OCCC4CCCCN4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C3=C(C=C(C=C3)Cl)N(C2=O)C#C)OCCC4CCCCN4)C

InChI

InChI=1S/C26H27ClN2O2/c1-4-29-23-16-20(27)8-9-22(23)25(31-12-10-21-7-5-6-11-28-21)24(26(29)30)19-14-17(2)13-18(3)15-19/h1,8-9,13-16,21,28H,5-7,10-12H2,2-3H3