4-ethanoyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylphenyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylphenyl]-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-1H-pyrrole-2-carboxamide Formula: C20H27N4O2+ MolecularWeight: 355.45398

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=CN3)C(=O)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=CN3)C(=O)C)C

InChI

InChI=1S/C20H26N4O2/c1-4-23-7-9-24(10-8-23)19-6-5-17(11-14(19)2)22-20(26)18-12-16(13-21-18)15(3)25/h5-6,11-13,21H,4,7-10H2,1-3H3,(H,22,26)/p+1