(E)-3-(1,3-benzodioxol-5-ylamino)-3-(4-bromophenyl)prop-2-enenitrile

Systemtic Name: (E)-3-(1,3-benzodioxol-5-ylamino)-3-(4-bromophenyl)prop-2-enenitrile Openeye Name: (E)-3-(1,3-benzodioxol-5-ylamino)-3-(4-bromophenyl)prop-2-enenitrile CAS Name: (E)-3-(1,3-benzodioxol-5-ylamino)-3-(4-bromophenyl)-2-propenenitrile IUPAC Name: (E)-3-(1,3-benzodioxol-5-ylamino)-3-(4-bromophenyl)prop-2-enenitrile Traditional Name: (E)-3-(1,3-benzodioxol-5-ylamino)-3-(4-bromophenyl)acrylonitrile Formula: C16H11BrN2O2 MolecularWeight: 343.17474

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=CC#N)C3=CC=C(C=C3)Br

Isomeric SMILES

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

InChI

InChI=1S/C16H11BrN2O2/c17-12-3-1-11(2-4-12)14(7-8-18)19-13-5-6-15-16(9-13)21-10-20-15/h1-7,9,19H,10H2/b14-7+