(2S)-2-azanyl-N-(3-bromanyl-4-methyl-phenyl)propanamide

Systemtic Name: (2S)-2-azanyl-N-(3-bromanyl-4-methyl-phenyl)propanamide Openeye Name: (2S)-2-amino-N-(3-bromo-4-methyl-phenyl)propanamide CAS Name: (2S)-2-amino-N-(3-bromo-4-methylphenyl)propanamide IUPAC Name: (2S)-2-amino-N-(3-bromo-4-methylphenyl)propanamide Traditional Name: (2S)-2-amino-N-(3-bromo-4-methyl-phenyl)propionamide Formula: C10H13BrN2O MolecularWeight: 257.12702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)N)Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](C)N)Br

InChI

InChI=1S/C10H13BrN2O/c1-6-3-4-8(5-9(6)11)13-10(14)7(2)12/h3-5,7H,12H2,1-2H3,(H,13,14)/t7-/m0/s1