5-bromanyl-1-[(1S)-1-naphthalen-1-ylethyl]-3,4-dihydro-2H-pyridin-1-ium-5-carboxamide

Systemtic Name: 5-bromanyl-1-[(1S)-1-naphthalen-1-ylethyl]-3,4-dihydro-2H-pyridin-1-ium-5-carboxamide Openeye Name: 5-bromo-1-[(1S)-1-(1-naphthyl)ethyl]-3,4-dihydro-2H-pyridin-1-ium-5-carboxamide CAS Name: 5-bromo-1-[(1S)-1-(1-naphthalenyl)ethyl]-3,4-dihydro-2H-pyridin-1-ium-5-carboxamide IUPAC Name: 5-bromo-1-[(1S)-1-naphthalen-1-ylethyl]-3,4-dihydro-2H-pyridin-1-ium-5-carboxamide Traditional Name: 5-bromo-1-[(1S)-1-(1-naphthyl)ethyl]-3,4-dihydro-2H-pyridin-1-ium-5-carboxamide Formula: C18H20BrN2O+ MolecularWeight: 360.2682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)[N+]3=CC(CCC3)(C(=O)N)Br

Isomeric SMILES

C[C@@H](C1=CC=CC2=CC=CC=C21)[N+]3=CC(CCC3)(C(=O)N)Br

InChI

InChI=1S/C18H19BrN2O/c1-13(21-11-5-10-18(19,12-21)17(20)22)15-9-4-7-14-6-2-3-8-16(14)15/h2-4,6-9,12-13H,5,10-11H2,1H3,(H-,20,22)/p+1/t13-,18?/m0/s1