3,4-dihydro-1H-isoquinolin-2-yl-(1-phenethylpiperidin-1-ium-4-yl)methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-(1-phenethylpiperidin-1-ium-4-yl)methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-(1-phenethylpiperidin-1-ium-4-yl)methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-(1-phenethyl-4-piperidin-1-iumyl)methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-(1-phenethylpiperidin-1-ium-4-yl)methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(1-phenethylpiperidin-1-ium-4-yl)methanone Formula: C23H29N2O+ MolecularWeight: 349.48916

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N2CCC3=CC=CC=C3C2)CCC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1C(=O)N2CCC3=CC=CC=C3C2)CCC4=CC=CC=C4

InChI

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