(E)-2-cyclopropylcarbonyl-3-[[4-(3,4-dimethoxyphenoxy)phenyl]amino]-3-oxidanyl-prop-2-enenitrile

Systemtic Name: (E)-2-cyclopropylcarbonyl-3-[[4-(3,4-dimethoxyphenoxy)phenyl]amino]-3-oxidanyl-prop-2-enenitrile Openeye Name: (E)-2-(cyclopropanecarbonyl)-3-[4-(3,4-dimethoxyphenoxy)anilino]-3-hydroxy-prop-2-enenitrile CAS Name: (E)-2-[cyclopropyl(oxo)methyl]-3-[4-(3,4-dimethoxyphenoxy)anilino]-3-hydroxy-2-propenenitrile IUPAC Name: (E)-2-(cyclopropanecarbonyl)-3-[4-(3,4-dimethoxyphenoxy)anilino]-3-hydroxyprop-2-enenitrile Traditional Name: (E)-2-(cyclopropanecarbonyl)-3-[4-(3,4-dimethoxyphenoxy)anilino]-3-hydroxy-acrylonitrile Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)OC2=CC=C(C=C2)NC(=C(C#N)C(=O)C3CC3)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)OC2=CC=C(C=C2)N/C(=C(/C#N)\C(=O)C3CC3)/O)OC

InChI

InChI=1S/C21H20N2O5/c1-26-18-10-9-16(11-19(18)27-2)28-15-7-5-14(6-8-15)23-21(25)17(12-22)20(24)13-3-4-13/h5-11,13,23,25H,3-4H2,1-2H3/b21-17+