tert-butyl (E)-2-azanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[2-(phenylmethoxycarbonylamino)ethoxyamino]prop-2-enoate

Systemtic Name: tert-butyl (E)-2-azanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[2-(phenylmethoxycarbonylamino)ethoxyamino]prop-2-enoate Openeye Name: tert-butyl (E)-2-amino-3-[2-(benzyloxycarbonylamino)ethoxyamino]-3-(tert-butoxycarbonylamino)prop-2-enoate CAS Name: (E)-2-amino-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[2-(phenylmethoxycarbonylamino)ethoxyamino]-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-2-amino-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[2-(phenylmethoxycarbonylamino)ethoxyamino]prop-2-enoate Traditional Name: (E)-2-amino-3-[2-(benzyloxycarbonylamino)ethoxyamino]-3-(tert-butoxycarbonylamino)acrylic acid tert-butyl ester Formula: C22H34N4O7 MolecularWeight: 466.52796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=C(NC(=O)OC(C)(C)C)NOCCNC(=O)OCC1=CC=CC=C1)N

Isomeric SMILES

CC(C)(C)OC(=O)/C(=C(/NC(=O)OC(C)(C)C)\NOCCNC(=O)OCC1=CC=CC=C1)/N

InChI

InChI=1S/C22H34N4O7/c1-21(2,3)32-18(27)16(23)17(25-20(29)33-22(4,5)6)26-31-13-12-24-19(28)30-14-15-10-8-7-9-11-15/h7-11,26H,12-14,23H2,1-6H3,(H,24,28)(H,25,29)/b17-16+