(4-nitrophenyl) (E)-3-[1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrol-2-yl]prop-2-enoate

Systemtic Name: (4-nitrophenyl) (E)-3-[1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrol-2-yl]prop-2-enoate Openeye Name: (4-nitrophenyl) (E)-3-[4-(tert-butoxycarbonylamino)-1-methyl-pyrrol-2-yl]prop-2-enoate CAS Name: (E)-3-[1-methyl-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-pyrrolyl]-2-propenoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) (E)-3-[1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrol-2-yl]prop-2-enoate Traditional Name: (E)-3-[4-(tert-butoxycarbonylamino)-1-methyl-pyrrol-2-yl]acrylic acid (4-nitrophenyl) ester Formula: C19H21N3O6 MolecularWeight: 387.38654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CN(C(=C1)C=CC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CN(C(=C1)/C=C/C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C19H21N3O6/c1-19(2,3)28-18(24)20-13-11-15(21(4)12-13)7-10-17(23)27-16-8-5-14(6-9-16)22(25)26/h5-12H,1-4H3,(H,20,24)/b10-7+