phenyl-[2-(4-piperidin-1-ylpiperidin-1-yl)-3,4-dihydro-1H-isoquinolin-1-yl]methanone

Systemtic Name: phenyl-[2-(4-piperidin-1-ylpiperidin-1-yl)-3,4-dihydro-1H-isoquinolin-1-yl]methanone Openeye Name: phenyl-[2-[4-(1-piperidyl)-1-piperidyl]-3,4-dihydro-1H-isoquinolin-1-yl]methanone CAS Name: phenyl-[2-[4-(1-piperidinyl)-1-piperidinyl]-3,4-dihydro-1H-isoquinolin-1-yl]methanone IUPAC Name: phenyl-[2-(4-piperidin-1-ylpiperidin-1-yl)-3,4-dihydro-1H-isoquinolin-1-yl]methanone Traditional Name: phenyl-[2-(4-piperidinopiperidino)-3,4-dihydro-1H-isoquinolin-1-yl]methanone Formula: C26H33N3O MolecularWeight: 403.55972

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)N3CCC4=CC=CC=C4C3C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)N3CCC4=CC=CC=C4C3C(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H33N3O/c30-26(22-10-3-1-4-11-22)25-24-12-6-5-9-21(24)13-20-29(25)28-18-14-23(15-19-28)27-16-7-2-8-17-27/h1,3-6,9-12,23,25H,2,7-8,13-20H2