(2S,3S)-2-azanyl-N-(3-chloranyl-2-methyl-phenyl)-3-methyl-pentanamide

Systemtic Name: (2S,3S)-2-azanyl-N-(3-chloranyl-2-methyl-phenyl)-3-methyl-pentanamide Openeye Name: (2S,3S)-2-amino-N-(3-chloro-2-methyl-phenyl)-3-methyl-pentanamide CAS Name: (2S,3S)-2-amino-N-(3-chloro-2-methylphenyl)-3-methylpentanamide IUPAC Name: (2S,3S)-2-amino-N-(3-chloro-2-methylphenyl)-3-methylpentanamide Traditional Name: (2S,3S)-2-amino-N-(3-chloro-2-methyl-phenyl)-3-methyl-valeramide Formula: C13H19ClN2O MolecularWeight: 254.75576

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=C(C(=CC=C1)Cl)C)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NC1=C(C(=CC=C1)Cl)C)N

InChI

InChI=1S/C13H19ClN2O/c1-4-8(2)12(15)13(17)16-11-7-5-6-10(14)9(11)3/h5-8,12H,4,15H2,1-3H3,(H,16,17)/t8-,12-/m0/s1