2-methyl-3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]-3-oxidanylidene-2-(phenylmethyl)propanoic acid

Systemtic Name: 2-methyl-3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]-3-oxidanylidene-2-(phenylmethyl)propanoic acid Openeye Name: 2-benzyl-3-[4-(tert-butoxycarbonylamino)-1-piperidyl]-2-methyl-3-oxo-propanoic acid CAS Name: 2-methyl-3-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-piperidinyl]-3-oxo-2-(phenylmethyl)propanoic acid IUPAC Name: 2-benzyl-2-methyl-3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]-3-oxopropanoic acid Traditional Name: 2-benzyl-3-[4-(tert-butoxycarbonylamino)piperidino]-3-keto-2-methyl-propionic acid Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(CC1)C(=O)C(C)(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCN(CC1)C(=O)C(C)(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C21H30N2O5/c1-20(2,3)28-19(27)22-16-10-12-23(13-11-16)17(24)21(4,18(25)26)14-15-8-6-5-7-9-15/h5-9,16H,10-14H2,1-4H3,(H,22,27)(H,25,26)