propan-2-yl (E)-2-cyano-3-[3-ethoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate

Systemtic Name: propan-2-yl (E)-2-cyano-3-[3-ethoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate Openeye Name: isopropyl (E)-2-cyano-3-(3-ethoxy-4-isobutoxy-phenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-[3-ethoxy-4-(2-methylpropoxy)phenyl]-2-propenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-2-cyano-3-[3-ethoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-(3-ethoxy-4-isobutoxy-phenyl)acrylic acid isopropyl ester Formula: C19H25NO4 MolecularWeight: 331.4061

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)OC(C)C)OCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)OC(C)C)OCC(C)C

InChI

InChI=1S/C19H25NO4/c1-6-22-18-10-15(7-8-17(18)23-12-13(2)3)9-16(11-20)19(21)24-14(4)5/h7-10,13-14H,6,12H2,1-5H3/b16-9+