propan-2-yl (E)-3-[3-(benzimidazol-1-ylmethyl)-2,5-dimethyl-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: propan-2-yl (E)-3-[3-(benzimidazol-1-ylmethyl)-2,5-dimethyl-phenyl]-2-cyano-prop-2-enoate Openeye Name: isopropyl (E)-3-[3-(benzimidazol-1-ylmethyl)-2,5-dimethyl-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[3-(1-benzimidazolylmethyl)-2,5-dimethylphenyl]-2-cyano-2-propenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-3-[3-(benzimidazol-1-ylmethyl)-2,5-dimethylphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[3-(benzimidazol-1-ylmethyl)-2,5-dimethyl-phenyl]-2-cyano-acrylic acid isopropyl ester Formula: C23H23N3O2 MolecularWeight: 373.44762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C=C(C#N)C(=O)OC(C)C)C)CN2C=NC3=CC=CC=C32

Isomeric SMILES

CC1=CC(=C(C(=C1)/C=C(\C#N)/C(=O)OC(C)C)C)CN2C=NC3=CC=CC=C32

InChI

InChI=1S/C23H23N3O2/c1-15(2)28-23(27)19(12-24)11-18-9-16(3)10-20(17(18)4)13-26-14-25-21-7-5-6-8-22(21)26/h5-11,14-15H,13H2,1-4H3/b19-11+