2-azanyl-3-(octylamino)-3-oxidanylidene-2-phenyl-propanoic acid

Systemtic Name: 2-azanyl-3-(octylamino)-3-oxidanylidene-2-phenyl-propanoic acid Openeye Name: 2-amino-3-(octylamino)-3-oxo-2-phenyl-propanoic acid CAS Name: 2-amino-3-(octylamino)-3-oxo-2-phenylpropanoic acid IUPAC Name: 2-amino-3-(octylamino)-3-oxo-2-phenylpropanoic acid Traditional Name: 2-amino-3-keto-3-(octylamino)-2-phenyl-propionic acid Formula: C17H26N2O3 MolecularWeight: 306.39994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C(C1=CC=CC=C1)(C(=O)O)N

Isomeric SMILES

CCCCCCCCNC(=O)C(C1=CC=CC=C1)(C(=O)O)N

InChI

InChI=1S/C17H26N2O3/c1-2-3-4-5-6-10-13-19-15(20)17(18,16(21)22)14-11-8-7-9-12-14/h7-9,11-12H,2-6,10,13,18H2,1H3,(H,19,20)(H,21,22)