phenyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)propanoate

Systemtic Name: phenyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)propanoate Openeye Name: phenyl 2-(tert-butoxycarbonylamino)-3-(4-nitrophenyl)propanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(4-nitrophenyl)propanoic acid phenyl ester IUPAC Name: phenyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(4-nitrophenyl)propionic acid phenyl ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C20H22N2O6/c1-20(2,3)28-19(24)21-17(18(23)27-16-7-5-4-6-8-16)13-14-9-11-15(12-10-14)22(25)26/h4-12,17H,13H2,1-3H3,(H,21,24)