[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium Openeye Name: [(1R)-2-anilino-1-methyl-2-oxo-ethyl]-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [(2R)-1-anilino-1-oxopropan-2-yl]-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylammonium IUPAC Name: [(2R)-1-anilino-1-oxopropan-2-yl]-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylazanium Traditional Name: [(1R)-2-anilino-2-keto-1-methyl-ethyl]-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C19H23BrN3O2+ MolecularWeight: 405.30882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)C(C)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)[C@H](C)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C19H22BrN3O2/c1-13-11-15(20)9-10-17(13)22-18(24)12-23(3)14(2)19(25)21-16-7-5-4-6-8-16/h4-11,14H,12H2,1-3H3,(H,21,25)(H,22,24)/p+1/t14-/m1/s1