methyl 3-[(2-ethoxy-2-oxidanylidene-ethyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: methyl 3-[(2-ethoxy-2-oxidanylidene-ethyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-3-[tert-butoxycarbonyl-(2-ethoxy-2-oxo-ethyl)amino]propanoate CAS Name: 3-[(2-ethoxy-2-oxoethyl)-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl 3-[(2-ethoxy-2-oxoethyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-[tert-butoxycarbonyl-(2-ethoxy-2-keto-ethyl)amino]propionic acid methyl ester Formula: C21H30N2O8 MolecularWeight: 438.4715

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC(C(=O)OC)NC(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CN(CC(C(=O)OC)NC(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H30N2O8/c1-6-29-17(24)13-23(20(27)31-21(2,3)4)12-16(18(25)28-5)22-19(26)30-14-15-10-8-7-9-11-15/h7-11,16H,6,12-14H2,1-5H3,(H,22,26)