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

Systemtic Name: 4-[(E)-3-(3-methoxyphenyl)-3-oxidanylidene-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[(E)-3-(3-methoxyphenyl)-3-oxo-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[(E)-3-(3-methoxyphenyl)-3-oxoprop-1-enyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[(E)-3-(3-methoxyphenyl)-3-oxoprop-1-enyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[(E)-3-keto-3-(3-methoxyphenyl)prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C17H16N2O2 MolecularWeight: 280.32114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O2/c1-12-13(9-15(11-18)19(12)2)7-8-17(20)14-5-4-6-16(10-14)21-3/h4-10H,1-3H3/b8-7+