3-[2-[[3-methyl-2-(naphthalen-1-ylcarbonylamino)butanoyl]amino]propanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[2-[[3-methyl-2-(naphthalen-1-ylcarbonylamino)butanoyl]amino]propanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[2-[[3-methyl-2-(naphthalene-1-carbonylamino)butanoyl]amino]propanoylamino]-4-oxo-butanoic acid CAS Name: 3-[[2-[[3-methyl-2-[[1-naphthalenyl(oxo)methyl]amino]-1-oxobutyl]amino]-1-oxopropyl]amino]-4-oxobutanoic acid IUPAC Name: 3-[2-[[3-methyl-2-(naphthalene-1-carbonylamino)butanoyl]amino]propanoylamino]-4-oxobutanoic acid Traditional Name: 4-keto-3-[2-[[3-methyl-2-(1-naphthoylamino)butanoyl]amino]propanoylamino]butyric acid Formula: C23H27N3O6 MolecularWeight: 441.47698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O6/c1-13(2)20(23(32)24-14(3)21(30)25-16(12-27)11-19(28)29)26-22(31)18-10-6-8-15-7-4-5-9-17(15)18/h4-10,12-14,16,20H,11H2,1-3H3,(H,24,32)(H,25,30)(H,26,31)(H,28,29)