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

Systemtic Name: 4-[(E)-3-(3-chlorophenyl)-3-oxidanylidene-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[(E)-3-(3-chlorophenyl)-3-oxo-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[(E)-3-(3-chlorophenyl)-3-oxoprop-1-enyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[(E)-3-(3-chlorophenyl)-3-oxoprop-1-enyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[(E)-3-(3-chlorophenyl)-3-keto-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C16H13ClN2O MolecularWeight: 284.74022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClN2O/c1-11-12(9-15(10-18)19(11)2)6-7-16(20)13-4-3-5-14(17)8-13/h3-9H,1-2H3/b7-6+