propan-2-yl (E)-2-cyano-3-[4-methoxy-3-[(4-nitrophenyl)methoxy]phenyl]prop-2-enoate

Systemtic Name: propan-2-yl (E)-2-cyano-3-[4-methoxy-3-[(4-nitrophenyl)methoxy]phenyl]prop-2-enoate Openeye Name: isopropyl (E)-2-cyano-3-[4-methoxy-3-[(4-nitrophenyl)methoxy]phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[4-methoxy-3-[(4-nitrophenyl)methoxy]phenyl]-2-propenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-2-cyano-3-[4-methoxy-3-[(4-nitrophenyl)methoxy]phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-methoxy-3-(4-nitrobenzyl)oxy-phenyl]acrylic acid isopropyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(=CC1=CC(=C(C=C1)OC)OCC2=CC=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CC(C)OC(=O)/C(=C/C1=CC(=C(C=C1)OC)OCC2=CC=C(C=C2)[N+](=O)[O-])/C#N

InChI

InChI=1S/C21H20N2O6/c1-14(2)29-21(24)17(12-22)10-16-6-9-19(27-3)20(11-16)28-13-15-4-7-18(8-5-15)23(25)26/h4-11,14H,13H2,1-3H3/b17-10+