3-[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-morpholin-4-ylcarbonyl-prop-2-enenitrile

Systemtic Name: 3-[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-morpholin-4-ylcarbonyl-prop-2-enenitrile Openeye Name: 3-[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile CAS Name: 3-[1-(4-ethylphenyl)-2,5-dimethyl-3-pyrrolyl]-2-[4-morpholinyl(oxo)methyl]-2-propenenitrile IUPAC Name: 3-[1-(4-ethylphenyl)-2,5-dimethylpyrrol-3-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile Traditional Name: 3-[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(morpholine-4-carbonyl)acrylonitrile Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=CC(=C2C)C=C(C#N)C(=O)N3CCOCC3)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=CC(=C2C)C=C(C#N)C(=O)N3CCOCC3)C

InChI

InChI=1S/C22H25N3O2/c1-4-18-5-7-21(8-6-18)25-16(2)13-19(17(25)3)14-20(15-23)22(26)24-9-11-27-12-10-24/h5-8,13-14H,4,9-12H2,1-3H3