(E)-4-(1,3-benzodioxol-5-yl)-3-phenylazanyl-but-2-enenitrile

Systemtic Name: (E)-4-(1,3-benzodioxol-5-yl)-3-phenylazanyl-but-2-enenitrile Openeye Name: (E)-3-anilino-4-(1,3-benzodioxol-5-yl)but-2-enenitrile CAS Name: (E)-3-anilino-4-(1,3-benzodioxol-5-yl)-2-butenenitrile IUPAC Name: (E)-3-anilino-4-(1,3-benzodioxol-5-yl)but-2-enenitrile Traditional Name: (E)-3-anilino-4-(1,3-benzodioxol-5-yl)but-2-enenitrile Formula: C17H14N2O2 MolecularWeight: 278.30526

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC(=CC#N)NC3=CC=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C/C(=C\C#N)/NC3=CC=CC=C3

InChI

InChI=1S/C17H14N2O2/c18-9-8-15(19-14-4-2-1-3-5-14)10-13-6-7-16-17(11-13)21-12-20-16/h1-8,11,19H,10,12H2/b15-8+