(2S,3R)-2-azanyl-N-[2-(3-chlorophenyl)ethyl]-3-methyl-pentanamide

Systemtic Name: (2S,3R)-2-azanyl-N-[2-(3-chlorophenyl)ethyl]-3-methyl-pentanamide Openeye Name: (2S,3R)-2-amino-N-[2-(3-chlorophenyl)ethyl]-3-methyl-pentanamide CAS Name: (2S,3R)-2-amino-N-[2-(3-chlorophenyl)ethyl]-3-methylpentanamide IUPAC Name: (2S,3R)-2-amino-N-[2-(3-chlorophenyl)ethyl]-3-methylpentanamide Traditional Name: (2S,3R)-2-amino-N-[2-(3-chlorophenyl)ethyl]-3-methyl-valeramide Formula: C14H21ClN2O MolecularWeight: 268.78234

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCCC1=CC(=CC=C1)Cl)N

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)NCCC1=CC(=CC=C1)Cl)N

InChI

InChI=1S/C14H21ClN2O/c1-3-10(2)13(16)14(18)17-8-7-11-5-4-6-12(15)9-11/h4-6,9-10,13H,3,7-8,16H2,1-2H3,(H,17,18)/t10-,13+/m1/s1