2-(4-ethanoylpiperazin-1-yl)carbonyl-1-(2-phenoxyphenyl)pyrrole-3-carbonitrile

Systemtic Name: 2-(4-ethanoylpiperazin-1-yl)carbonyl-1-(2-phenoxyphenyl)pyrrole-3-carbonitrile Openeye Name: 2-(4-acetylpiperazine-1-carbonyl)-1-(2-phenoxyphenyl)pyrrole-3-carbonitrile CAS Name: 2-[(4-acetyl-1-piperazinyl)-oxomethyl]-1-(2-phenoxyphenyl)-3-pyrrolecarbonitrile IUPAC Name: 2-(4-acetylpiperazine-1-carbonyl)-1-(2-phenoxyphenyl)pyrrole-3-carbonitrile Traditional Name: 2-(4-acetylpiperazine-1-carbonyl)-1-(2-phenoxyphenyl)pyrrole-3-carbonitrile Formula: C24H22N4O3 MolecularWeight: 414.45648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=C(C=CN2C3=CC=CC=C3OC4=CC=CC=C4)C#N

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=C(C=CN2C3=CC=CC=C3OC4=CC=CC=C4)C#N

InChI

InChI=1S/C24H22N4O3/c1-18(29)26-13-15-27(16-14-26)24(30)23-19(17-25)11-12-28(23)21-9-5-6-10-22(21)31-20-7-3-2-4-8-20/h2-12H,13-16H2,1H3