2-(butylamino)-3-phenyl-propanoic acid; ethane-1,2-diamine

Systemtic Name: 2-(butylamino)-3-phenyl-propanoic acid; ethane-1,2-diamine Openeye Name: 2-(butylamino)-3-phenyl-propanoic acid; ethane-1,2-diamine CAS Name: 2-(butylamino)-3-phenylpropanoic acid; ethane-1,2-diamine IUPAC Name: 2-(butylamino)-3-phenylpropanoic acid; ethane-1,2-diamine Traditional Name: 2-aminoethylamine; 2-(butylamino)-3-phenyl-propionic acid Formula: C15H27N3O2 MolecularWeight: 281.39378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(CC1=CC=CC=C1)C(=O)O.C(CN)N

Isomeric SMILES

CCCCNC(CC1=CC=CC=C1)C(=O)O.C(CN)N

InChI

InChI=1S/C13H19NO2.C2H8N2/c1-2-3-9-14-12(13(15)16)10-11-7-5-4-6-8-11;3-1-2-4/h4-8,12,14H,2-3,9-10H2,1H3,(H,15,16);1-4H2