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

Systemtic Name: 3-[[1-[2-(2,2-diphenylethanoylamino)-3-methyl-butanoyl]pyrrolidin-2-yl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[1-[2-[(2,2-diphenylacetyl)amino]-3-methyl-butanoyl]pyrrolidine-2-carbonyl]amino]-4-oxo-butanoic acid CAS Name: 3-[[[1-[3-methyl-1-oxo-2-[(1-oxo-2,2-diphenylethyl)amino]butyl]-2-pyrrolidinyl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 3-[[1-[2-[(2,2-diphenylacetyl)amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]-4-oxobutanoic acid Traditional Name: 3-[[1-[2-[(2,2-diphenylacetyl)amino]-3-methyl-butanoyl]prolyl]amino]-4-keto-butyric acid Formula: C28H33N3O6 MolecularWeight: 507.57812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCC1C(=O)NC(CC(=O)O)C=O)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)N1CCCC1C(=O)NC(CC(=O)O)C=O)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C28H33N3O6/c1-18(2)25(28(37)31-15-9-14-22(31)26(35)29-21(17-32)16-23(33)34)30-27(36)24(19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-8,10-13,17-18,21-22,24-25H,9,14-16H2,1-2H3,(H,29,35)(H,30,36)(H,33,34)