3-[[1-(2-benzamido-3-methyl-butanoyl)-3-methyl-pyrrolidin-2-yl]carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[[1-(2-benzamido-3-methyl-butanoyl)-3-methyl-pyrrolidin-2-yl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[1-(2-benzamido-3-methyl-butanoyl)-3-methyl-pyrrolidine-2-carbonyl]amino]-4-oxo-butanoic acid CAS Name: 3-[[[1-(2-benzamido-3-methyl-1-oxobutyl)-3-methyl-2-pyrrolidinyl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 3-[[1-(2-benzamido-3-methylbutanoyl)-3-methylpyrrolidine-2-carbonyl]amino]-4-oxobutanoic acid Traditional Name: 3-[[1-(2-benzamido-3-methyl-butanoyl)-3-methyl-prolyl]amino]-4-keto-butyric acid Formula: C22H29N3O6 MolecularWeight: 431.48216

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C1C(=O)NC(CC(=O)O)C=O)C(=O)C(C(C)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1CCN(C1C(=O)NC(CC(=O)O)C=O)C(=O)C(C(C)C)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H29N3O6/c1-13(2)18(24-20(29)15-7-5-4-6-8-15)22(31)25-10-9-14(3)19(25)21(30)23-16(12-26)11-17(27)28/h4-8,12-14,16,18-19H,9-11H2,1-3H3,(H,23,30)(H,24,29)(H,27,28)