aminocarbonyl (E)-3-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]prop-2-enoate

Systemtic Name: aminocarbonyl (E)-3-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]prop-2-enoate Openeye Name: carbamoyl (E)-3-[4-[2-(tert-butoxycarbonylamino)phenyl]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]phenyl]-2-propenoic acid carbamoyl ester IUPAC Name: carbamoyl (E)-3-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[2-(tert-butoxycarbonylamino)phenyl]phenyl]acrylic acid carbamoyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC=C1C2=CC=C(C=C2)C=CC(=O)OC(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC=C1C2=CC=C(C=C2)/C=C/C(=O)OC(=O)N

InChI

InChI=1S/C21H22N2O5/c1-21(2,3)28-20(26)23-17-7-5-4-6-16(17)15-11-8-14(9-12-15)10-13-18(24)27-19(22)25/h4-13H,1-3H3,(H2,22,25)(H,23,26)/b13-10+