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

Systemtic Name: 2-azanyl-3-(dodecylamino)-3-oxidanylidene-2-phenyl-propanoic acid Openeye Name: 2-amino-3-(dodecylamino)-3-oxo-2-phenyl-propanoic acid CAS Name: 2-amino-3-(dodecylamino)-3-oxo-2-phenylpropanoic acid IUPAC Name: 2-amino-3-(dodecylamino)-3-oxo-2-phenylpropanoic acid Traditional Name: 2-amino-3-keto-3-(laurylamino)-2-phenyl-propionic acid Formula: C21H34N2O3 MolecularWeight: 362.50626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34N2O3/c1-2-3-4-5-6-7-8-9-10-14-17-23-19(24)21(22,20(25)26)18-15-12-11-13-16-18/h11-13,15-16H,2-10,14,17,22H2,1H3,(H,23,24)(H,25,26)