1-(2-aminophenyl)-4-(2-piperidin-1-ylethyl)-2,4-dihydro-1H-isoquinolin-3-one

Systemtic Name: 1-(2-aminophenyl)-4-(2-piperidin-1-ylethyl)-2,4-dihydro-1H-isoquinolin-3-one Openeye Name: 1-(2-aminophenyl)-4-[2-(1-piperidyl)ethyl]-2,4-dihydro-1H-isoquinolin-3-one CAS Name: 1-(2-aminophenyl)-4-[2-(1-piperidinyl)ethyl]-2,4-dihydro-1H-isoquinolin-3-one IUPAC Name: 1-(2-aminophenyl)-4-(2-piperidin-1-ylethyl)-2,4-dihydro-1H-isoquinolin-3-one Traditional Name: 1-(2-aminophenyl)-4-(2-piperidinoethyl)-2,4-dihydro-1H-isoquinolin-3-one Formula: C22H27N3O MolecularWeight: 349.46928

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC2C3=CC=CC=C3C(NC2=O)C4=CC=CC=C4N

Isomeric SMILES

C1CCN(CC1)CCC2C3=CC=CC=C3C(NC2=O)C4=CC=CC=C4N

InChI

InChI=1S/C22H27N3O/c23-20-11-5-4-10-19(20)21-17-9-3-2-8-16(17)18(22(26)24-21)12-15-25-13-6-1-7-14-25/h2-5,8-11,18,21H,1,6-7,12-15,23H2,(H,24,26)