2-azanyl-3-(2-octylphenyl)-3-oxidanylidene-propanoic acid

Systemtic Name: 2-azanyl-3-(2-octylphenyl)-3-oxidanylidene-propanoic acid Openeye Name: 2-amino-3-(2-octylphenyl)-3-oxo-propanoic acid CAS Name: 2-amino-3-(2-octylphenyl)-3-oxopropanoic acid IUPAC Name: 2-amino-3-(2-octylphenyl)-3-oxopropanoic acid Traditional Name: 2-amino-3-keto-3-(2-octylphenyl)propionic acid Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC=C1C(=O)C(C(=O)O)N

Isomeric SMILES

CCCCCCCCC1=CC=CC=C1C(=O)C(C(=O)O)N

InChI

InChI=1S/C17H25NO3/c1-2-3-4-5-6-7-10-13-11-8-9-12-14(13)16(19)15(18)17(20)21/h8-9,11-12,15H,2-7,10,18H2,1H3,(H,20,21)