N-[(1R,2R)-2-azanyl-1-(4-bromophenyl)-3-oxidanyl-propyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(1R,2R)-2-azanyl-1-(4-bromophenyl)-3-oxidanyl-propyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R,2R)-2-amino-1-(4-bromophenyl)-3-hydroxy-propyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1R,2R)-2-amino-1-(4-bromophenyl)-3-hydroxypropyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1R,2R)-2-amino-1-(4-bromophenyl)-3-hydroxypropyl]-4-methylbenzenesulfonamide Traditional Name: N-[(1R,2R)-2-amino-1-(4-bromophenyl)-3-hydroxy-propyl]-4-methyl-benzenesulfonamide Formula: C16H19BrN2O3S MolecularWeight: 399.30266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=C(C=C2)Br)C(CO)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H](C2=CC=C(C=C2)Br)[C@H](CO)N

InChI

InChI=1S/C16H19BrN2O3S/c1-11-2-8-14(9-3-11)23(21,22)19-16(15(18)10-20)12-4-6-13(17)7-5-12/h2-9,15-16,19-20H,10,18H2,1H3/t15-,16+/m0/s1