propan-2-yl (Z)-3-[3,4-bis(oxidanyl)phenyl]-2-cyano-prop-2-enoate

Systemtic Name: propan-2-yl (Z)-3-[3,4-bis(oxidanyl)phenyl]-2-cyano-prop-2-enoate Openeye Name: isopropyl (Z)-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enoate CAS Name: (Z)-2-cyano-3-(3,4-dihydroxyphenyl)-2-propenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (Z)-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enoate Traditional Name: (Z)-2-cyano-3-(3,4-dihydroxyphenyl)acrylic acid isopropyl ester Formula: C13H13NO4 MolecularWeight: 247.24662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(=CC1=CC(=C(C=C1)O)O)C#N

Isomeric SMILES

CC(C)OC(=O)/C(=C\C1=CC(=C(C=C1)O)O)/C#N

InChI

InChI=1S/C13H13NO4/c1-8(2)18-13(17)10(7-14)5-9-3-4-11(15)12(16)6-9/h3-6,8,15-16H,1-2H3/b10-5-