1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanone Openeye Name: 2-(4-benzylpiperidin-1-ium-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]ethanone IUPAC Name: 2-(4-benzylpiperidin-1-ium-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(4-benzylpiperidin-1-ium-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C23H29N2O+ MolecularWeight: 349.48916

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H28N2O/c26-23(25-15-12-21-8-4-5-9-22(21)17-25)18-24-13-10-20(11-14-24)16-19-6-2-1-3-7-19/h1-9,20H,10-18H2/p+1