(3S)-3-azanyl-4-[[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-phenyl-amino]-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-3-azanyl-4-[[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-phenyl-amino]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-amino-4-(N-(2-tert-butoxy-2-oxo-ethyl)anilino)-4-oxo-butanoic acid CAS Name: (3S)-3-amino-4-(N-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]anilino)-4-oxobutanoic acid IUPAC Name: (3S)-3-amino-4-(N-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]anilino)-4-oxobutanoic acid Traditional Name: (3S)-3-amino-4-(N-(2-tert-butoxy-2-keto-ethyl)anilino)-4-keto-butyric acid Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN(C1=CC=CC=C1)C(=O)C(CC(=O)O)N

Isomeric SMILES

CC(C)(C)OC(=O)CN(C1=CC=CC=C1)C(=O)[C@H](CC(=O)O)N

InChI

InChI=1S/C16H22N2O5/c1-16(2,3)23-14(21)10-18(11-7-5-4-6-8-11)15(22)12(17)9-13(19)20/h4-8,12H,9-10,17H2,1-3H3,(H,19,20)/t12-/m0/s1