(1S)-2-(azepan-1-ium-1-yl)-1-naphthalen-1-yl-ethanamine

Systemtic Name: (1S)-2-(azepan-1-ium-1-yl)-1-naphthalen-1-yl-ethanamine Openeye Name: (1S)-2-(azepan-1-ium-1-yl)-1-(1-naphthyl)ethanamine CAS Name: (1S)-2-(1-azepan-1-iumyl)-1-(1-naphthalenyl)ethanamine IUPAC Name: (1S)-2-(azepan-1-ium-1-yl)-1-naphthalen-1-ylethanamine Traditional Name: [(1S)-2-(azepan-1-ium-1-yl)-1-(1-naphthyl)ethyl]amine Formula: C18H25N2+ MolecularWeight: 269.4045

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC(C2=CC=CC3=CC=CC=C32)N

Isomeric SMILES

C1CCC[NH+](CC1)C[C@H](C2=CC=CC3=CC=CC=C32)N

InChI

InChI=1S/C18H24N2/c19-18(14-20-12-5-1-2-6-13-20)17-11-7-9-15-8-3-4-10-16(15)17/h3-4,7-11,18H,1-2,5-6,12-14,19H2/p+1/t18-/m1/s1