8-azanyl-2-(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-8-oxidanylidene-octanoic acid

Systemtic Name: 8-azanyl-2-(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-8-oxidanylidene-octanoic acid Openeye Name: 8-amino-2-(2-amino-1-benzyl-2-oxo-ethyl)-8-oxo-octanoic acid CAS Name: 8-amino-2-(1-amino-1-oxo-3-phenylpropan-2-yl)-8-oxooctanoic acid IUPAC Name: 8-amino-2-(1-amino-1-oxo-3-phenylpropan-2-yl)-8-oxooctanoic acid Traditional Name: 8-amino-2-(2-amino-1-benzyl-2-keto-ethyl)-8-keto-caprylic acid Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O4/c18-15(20)10-6-2-5-9-13(17(22)23)14(16(19)21)11-12-7-3-1-4-8-12/h1,3-4,7-8,13-14H,2,5-6,9-11H2,(H2,18,20)(H2,19,21)(H,22,23)