1-(1,4-diazepan-4-ium-1-yl)-2-naphthalen-1-yl-ethanone

Systemtic Name: 1-(1,4-diazepan-4-ium-1-yl)-2-naphthalen-1-yl-ethanone Openeye Name: 1-(1,4-diazepan-4-ium-1-yl)-2-(1-naphthyl)ethanone CAS Name: 1-(1,4-diazepan-4-ium-1-yl)-2-(1-naphthalenyl)ethanone IUPAC Name: 1-(1,4-diazepan-4-ium-1-yl)-2-naphthalen-1-ylethanone Traditional Name: 1-(1,4-diazepan-4-ium-1-yl)-2-(1-naphthyl)ethanone Formula: C17H21N2O+ MolecularWeight: 269.36144

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)C(=O)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

C1C[NH2+]CCN(C1)C(=O)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C17H20N2O/c20-17(19-11-4-9-18-10-12-19)13-15-7-3-6-14-5-1-2-8-16(14)15/h1-3,5-8,18H,4,9-13H2/p+1