tert-butyl 3-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-7-oxidanylidene-heptanoate

Systemtic Name: tert-butyl 3-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-7-oxidanylidene-heptanoate Openeye Name: tert-butyl 3-[[1-benzyl-2-(methylamino)-2-oxo-ethyl]carbamoyl]-7-oxo-heptanoate CAS Name: 3-[[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-7-oxoheptanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]-7-oxoheptanoate Traditional Name: 3-[[1-benzyl-2-keto-2-(methylamino)ethyl]carbamoyl]-7-keto-enanthic acid tert-butyl ester Formula: C22H32N2O5 MolecularWeight: 404.49988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CCCC=O)C(=O)NC(CC1=CC=CC=C1)C(=O)NC

Isomeric SMILES

CC(C)(C)OC(=O)CC(CCCC=O)C(=O)NC(CC1=CC=CC=C1)C(=O)NC

InChI

InChI=1S/C22H32N2O5/c1-22(2,3)29-19(26)15-17(12-8-9-13-25)20(27)24-18(21(28)23-4)14-16-10-6-5-7-11-16/h5-7,10-11,13,17-18H,8-9,12,14-15H2,1-4H3,(H,23,28)(H,24,27)