1-(3-bromophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-pyrrole-3-carbonitrile

Systemtic Name: 1-(3-bromophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-pyrrole-3-carbonitrile Openeye Name: 1-(3-bromophenyl)-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyrrole-3-carbonitrile CAS Name: 1-(3-bromophenyl)-2-[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]-3-pyrrolecarbonitrile IUPAC Name: 1-(3-bromophenyl)-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyrrole-3-carbonitrile Traditional Name: 1-(3-bromophenyl)-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyrrole-3-carbonitrile Formula: C23H21BrN4O2 MolecularWeight: 465.34244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=C(C=CN3C4=CC(=CC=C4)Br)C#N

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=C(C=CN3C4=CC(=CC=C4)Br)C#N

InChI

InChI=1S/C23H21BrN4O2/c1-30-21-8-3-2-7-20(21)26-11-13-27(14-12-26)23(29)22-17(16-25)9-10-28(22)19-6-4-5-18(24)15-19/h2-10,15H,11-14H2,1H3