[(2S)-3-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanyl-propyl]azanium

Systemtic Name: [(2S)-3-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-3-(2-bromo-4-methyl-anilino)-2-hydroxy-propyl]ammonium CAS Name: [(2S)-3-(2-bromo-4-methylanilino)-2-hydroxypropyl]ammonium IUPAC Name: [(2S)-3-(2-bromo-4-methylanilino)-2-hydroxypropyl]azanium Traditional Name: [(2S)-3-(2-bromo-4-methyl-anilino)-2-hydroxy-propyl]ammonium Formula: C10H16BrN2O+ MolecularWeight: 260.15084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NCC(C[NH3+])O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC[C@H](C[NH3+])O)Br

InChI

InChI=1S/C10H15BrN2O/c1-7-2-3-10(9(11)4-7)13-6-8(14)5-12/h2-4,8,13-14H,5-6,12H2,1H3/p+1/t8-/m0/s1