1-(8-chloranyl-2-ethanoyl-3,4-dihydro-1H-isoquinolin-5-yl)-3-[1-(phenylcarbonyl)piperidin-4-yl]propan-1-one

Systemtic Name: 1-(8-chloranyl-2-ethanoyl-3,4-dihydro-1H-isoquinolin-5-yl)-3-[1-(phenylcarbonyl)piperidin-4-yl]propan-1-one Openeye Name: 1-(2-acetyl-8-chloro-3,4-dihydro-1H-isoquinolin-5-yl)-3-(1-benzoyl-4-piperidyl)propan-1-one CAS Name: 1-(2-acetyl-8-chloro-3,4-dihydro-1H-isoquinolin-5-yl)-3-(1-benzoyl-4-piperidinyl)-1-propanone IUPAC Name: 1-(2-acetyl-8-chloro-3,4-dihydro-1H-isoquinolin-5-yl)-3-(1-benzoylpiperidin-4-yl)propan-1-one Traditional Name: 1-(2-acetyl-8-chloro-3,4-dihydro-1H-isoquinolin-5-yl)-3-(1-benzoyl-4-piperidyl)propan-1-one Formula: C26H29ClN2O3 MolecularWeight: 452.97306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C(C=CC(=C2C1)Cl)C(=O)CCC3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCC2=C(C=CC(=C2C1)Cl)C(=O)CCC3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H29ClN2O3/c1-18(30)29-16-13-21-22(8-9-24(27)23(21)17-29)25(31)10-7-19-11-14-28(15-12-19)26(32)20-5-3-2-4-6-20/h2-6,8-9,19H,7,10-17H2,1H3