5-bromanyl-N-[3-(naphthalen-1-ylmethylamino)-3-oxidanylidene-propyl]-N-phenyl-1-propyl-pyridin-1-ium-3-carboxamide

Systemtic Name: 5-bromanyl-N-[3-(naphthalen-1-ylmethylamino)-3-oxidanylidene-propyl]-N-phenyl-1-propyl-pyridin-1-ium-3-carboxamide Openeye Name: 5-bromo-N-[3-(1-naphthylmethylamino)-3-oxo-propyl]-N-phenyl-1-propyl-pyridin-1-ium-3-carboxamide CAS Name: 5-bromo-N-[3-(1-naphthalenylmethylamino)-3-oxopropyl]-N-phenyl-1-propyl-3-pyridin-1-iumcarboxamide IUPAC Name: 5-bromo-N-[3-(naphthalen-1-ylmethylamino)-3-oxopropyl]-N-phenyl-1-propylpyridin-1-ium-3-carboxamide Traditional Name: 5-bromo-N-[3-keto-3-(1-naphthylmethylamino)propyl]-N-phenyl-1-propyl-pyridin-1-ium-3-carboxamide Formula: C29H29BrN3O2+ MolecularWeight: 531.46346

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=CC(=CC(=C1)Br)C(=O)N(CCC(=O)NCC2=CC=CC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCC[N+]1=CC(=CC(=C1)Br)C(=O)N(CCC(=O)NCC2=CC=CC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C29H28BrN3O2/c1-2-16-32-20-24(18-25(30)21-32)29(35)33(26-12-4-3-5-13-26)17-15-28(34)31-19-23-11-8-10-22-9-6-7-14-27(22)23/h3-14,18,20-21H,2,15-17,19H2,1H3/p+1