(E)-2-(4-phenylpiperazin-1-yl)carbonyl-3-(1H-pyrrol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-phenylpiperazin-1-yl)carbonyl-3-(1H-pyrrol-2-yl)prop-2-enenitrile Openeye Name: (E)-2-(4-phenylpiperazine-1-carbonyl)-3-(1H-pyrrol-2-yl)prop-2-enenitrile CAS Name: (E)-2-[oxo-(4-phenyl-1-piperazinyl)methyl]-3-(1H-pyrrol-2-yl)-2-propenenitrile IUPAC Name: (E)-2-(4-phenylpiperazine-1-carbonyl)-3-(1H-pyrrol-2-yl)prop-2-enenitrile Traditional Name: (E)-2-(4-phenylpiperazine-1-carbonyl)-3-(1H-pyrrol-2-yl)acrylonitrile Formula: C18H18N4O MolecularWeight: 306.36172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C(=CC3=CC=CN3)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)/C(=C/C3=CC=CN3)/C#N

InChI

InChI=1S/C18H18N4O/c19-14-15(13-16-5-4-8-20-16)18(23)22-11-9-21(10-12-22)17-6-2-1-3-7-17/h1-8,13,20H,9-12H2/b15-13+