4-[(E)-3-(2-bromophenyl)-3-oxidanylidene-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile

Systemtic Name: 4-[(E)-3-(2-bromophenyl)-3-oxidanylidene-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[(E)-3-(2-bromophenyl)-3-oxo-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[(E)-3-(2-bromophenyl)-3-oxoprop-1-enyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[(E)-3-(2-bromophenyl)-3-oxoprop-1-enyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[(E)-3-(2-bromophenyl)-3-keto-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C16H13BrN2O MolecularWeight: 329.19122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C)C#N)C=CC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC1=C(C=C(N1C)C#N)/C=C/C(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C16H13BrN2O/c1-11-12(9-13(10-18)19(11)2)7-8-16(20)14-5-3-4-6-15(14)17/h3-9H,1-2H3/b8-7+