[(1S)-1-(5-bromanyl-2-oxidanyl-phenyl)propyl]-(1-propan-2-ylpiperidin-4-yl)azanium

Systemtic Name: [(1S)-1-(5-bromanyl-2-oxidanyl-phenyl)propyl]-(1-propan-2-ylpiperidin-4-yl)azanium Openeye Name: [(1S)-1-(5-bromo-2-hydroxy-phenyl)propyl]-(1-isopropyl-4-piperidyl)ammonium CAS Name: [(1S)-1-(5-bromo-2-hydroxyphenyl)propyl]-(1-propan-2-yl-4-piperidinyl)ammonium IUPAC Name: [(1S)-1-(5-bromo-2-hydroxyphenyl)propyl]-(1-propan-2-ylpiperidin-4-yl)azanium Traditional Name: [(1S)-1-(5-bromo-2-hydroxy-phenyl)propyl]-(1-isopropyl-4-piperidyl)ammonium Formula: C17H28BrN2O+ MolecularWeight: 356.32102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC(=C1)Br)O)[NH2+]C2CCN(CC2)C(C)C

Isomeric SMILES

CC[C@@H](C1=C(C=CC(=C1)Br)O)[NH2+]C2CCN(CC2)C(C)C

InChI

InChI=1S/C17H27BrN2O/c1-4-16(15-11-13(18)5-6-17(15)21)19-14-7-9-20(10-8-14)12(2)3/h5-6,11-12,14,16,19,21H,4,7-10H2,1-3H3/p+1/t16-/m0/s1