3-[2-[[2-(1-naphthalen-1-ylethylamino)-2-oxidanylidene-ethanoyl]amino]propanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[2-[[2-(1-naphthalen-1-ylethylamino)-2-oxidanylidene-ethanoyl]amino]propanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[2-[[2-[1-(1-naphthyl)ethylamino]-2-oxo-acetyl]amino]propanoylamino]-4-oxo-butanoic acid CAS Name: 3-[[2-[[2-[1-(1-naphthalenyl)ethylamino]-1,2-dioxoethyl]amino]-1-oxopropyl]amino]-4-oxobutanoic acid IUPAC Name: 3-[2-[[2-(1-naphthalen-1-ylethylamino)-2-oxoacetyl]amino]propanoylamino]-4-oxobutanoic acid Traditional Name: 4-keto-3-[2-[[2-keto-2-[1-(1-naphthyl)ethylamino]acetyl]amino]propanoylamino]butyric acid Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(=O)NC(C)C(=O)NC(CC(=O)O)C=O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(=O)NC(C)C(=O)NC(CC(=O)O)C=O

InChI

InChI=1S/C21H23N3O6/c1-12(16-9-5-7-14-6-3-4-8-17(14)16)22-20(29)21(30)23-13(2)19(28)24-15(11-25)10-18(26)27/h3-9,11-13,15H,10H2,1-2H3,(H,22,29)(H,23,30)(H,24,28)(H,26,27)