3-[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-3-oxidanylidene-propanenitrile Openeye Name: 3-[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-3-oxo-propanenitrile CAS Name: 3-[1-(4-ethylphenyl)-2,5-dimethyl-3-pyrrolyl]-3-oxopropanenitrile IUPAC Name: 3-[1-(4-ethylphenyl)-2,5-dimethylpyrrol-3-yl]-3-oxopropanenitrile Traditional Name: 3-[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-3-keto-propionitrile Formula: C17H18N2O MolecularWeight: 266.33762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)CC#N)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)CC#N)C

InChI

InChI=1S/C17H18N2O/c1-4-14-5-7-15(8-6-14)19-12(2)11-16(13(19)3)17(20)9-10-18/h5-8,11H,4,9H2,1-3H3