ethyl (E)-3-[3-cyano-4-(imidazol-1-ylmethyl)phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-cyano-4-(imidazol-1-ylmethyl)phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[3-cyano-4-(imidazol-1-ylmethyl)phenyl]prop-2-enoate CAS Name: (E)-3-[3-cyano-4-(1-imidazolylmethyl)phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-cyano-4-(imidazol-1-ylmethyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3-cyano-4-(imidazol-1-ylmethyl)phenyl]acrylic acid ethyl ester Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC(=C(C=C1)CN2C=CN=C2)C#N

Isomeric SMILES

CCOC(=O)/C=C/C1=CC(=C(C=C1)CN2C=CN=C2)C#N

InChI

InChI=1S/C16H15N3O2/c1-2-21-16(20)6-4-13-3-5-14(15(9-13)10-17)11-19-8-7-18-12-19/h3-9,12H,2,11H2,1H3/b6-4+