(6-bromanyl-2-oxidanyl-naphthalen-1-yl)methyl-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium

Systemtic Name: (6-bromanyl-2-oxidanyl-naphthalen-1-yl)methyl-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: (6-bromo-2-hydroxy-1-naphthyl)methyl-[2-(isopropylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (6-bromo-2-hydroxy-1-naphthalenyl)methyl-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: (6-bromo-2-hydroxynaphthalen-1-yl)methyl-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: (6-bromo-2-hydroxy-1-naphthyl)methyl-[2-(isopropylamino)-2-keto-ethyl]-methyl-ammonium Formula: C17H22BrN2O2+ MolecularWeight: 366.27278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+](C)CC1=C(C=CC2=C1C=CC(=C2)Br)O

Isomeric SMILES

CC(C)NC(=O)C[NH+](C)CC1=C(C=CC2=C1C=CC(=C2)Br)O

InChI

InChI=1S/C17H21BrN2O2/c1-11(2)19-17(22)10-20(3)9-15-14-6-5-13(18)8-12(14)4-7-16(15)21/h4-8,11,21H,9-10H2,1-3H3,(H,19,22)/p+1