4-oxidanylidene-3-[2-[[1-(phenylmethyl)indol-2-yl]carbonylamino]propanoylamino]butanoic acid

Systemtic Name: 4-oxidanylidene-3-[2-[[1-(phenylmethyl)indol-2-yl]carbonylamino]propanoylamino]butanoic acid Openeye Name: 3-[2-[(1-benzylindole-2-carbonyl)amino]propanoylamino]-4-oxo-butanoic acid CAS Name: 4-oxo-3-[[1-oxo-2-[[oxo-[1-(phenylmethyl)-2-indolyl]methyl]amino]propyl]amino]butanoic acid IUPAC Name: 3-[2-[(1-benzylindole-2-carbonyl)amino]propanoylamino]-4-oxobutanoic acid Traditional Name: 3-[2-[(1-benzylindole-2-carbonyl)amino]propanoylamino]-4-keto-butyric acid Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)O)C=O)NC(=O)C1=CC2=CC=CC=C2N1CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC(CC(=O)O)C=O)NC(=O)C1=CC2=CC=CC=C2N1CC3=CC=CC=C3

InChI

InChI=1S/C23H23N3O5/c1-15(22(30)25-18(14-27)12-21(28)29)24-23(31)20-11-17-9-5-6-10-19(17)26(20)13-16-7-3-2-4-8-16/h2-11,14-15,18H,12-13H2,1H3,(H,24,31)(H,25,30)(H,28,29)