1-[4-(phenylmethyl)piperidin-1-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone

Systemtic Name: 1-[4-(phenylmethyl)piperidin-1-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone CAS Name: 1-[4-(phenylmethyl)-1-piperidinyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone Traditional Name: 1-(4-benzylpiperidino)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone Formula: C23H29N2O+ MolecularWeight: 349.48916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C[NH+]3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)C[NH+]3CCC4=CC=CC=C4C3

InChI

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