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

Systemtic Name: methyl (E)-2-cyano-3-[3-ethoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate Openeye Name: methyl (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 methyl ester IUPAC Name: methyl (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 methyl ester Formula: C17H21NO4 MolecularWeight: 303.35294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO4/c1-5-21-16-9-13(8-14(10-18)17(19)20-4)6-7-15(16)22-11-12(2)3/h6-9,12H,5,11H2,1-4H3/b14-8+