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

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)-2-phenyl-propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-(4-nitrophenyl)-2-phenyl-propanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(4-nitrophenyl)-2-phenylpropanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)-2-phenylpropanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-(4-nitrophenyl)-2-phenyl-propionic acid 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-])(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

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

InChI

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