2-azanyl-3-methyl-N-phenethyl-pentanamide; ethanoic acid

Systemtic Name: 2-azanyl-3-methyl-N-phenethyl-pentanamide; ethanoic acid Openeye Name: acetic acid; 2-amino-3-methyl-N-phenethyl-pentanamide CAS Name: acetic acid; 2-amino-3-methyl-N-phenethylpentanamide IUPAC Name: acetic acid; 2-amino-3-methyl-N-phenethylpentanamide Traditional Name: acetic acid; 2-amino-3-methyl-N-phenethyl-valeramide Formula: C16H26N2O3 MolecularWeight: 294.38924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O.C2H4O2/c1-3-11(2)13(15)14(17)16-10-9-12-7-5-4-6-8-12;1-2(3)4/h4-8,11,13H,3,9-10,15H2,1-2H3,(H,16,17);1H3,(H,3,4)