(4-methylpiperazin-4-ium-1-yl)-(4-pyrrol-1-ylphenyl)methanone

Systemtic Name: (4-methylpiperazin-4-ium-1-yl)-(4-pyrrol-1-ylphenyl)methanone Openeye Name: (4-methylpiperazin-4-ium-1-yl)-(4-pyrrol-1-ylphenyl)methanone CAS Name: (4-methyl-1-piperazin-4-iumyl)-[4-(1-pyrrolyl)phenyl]methanone IUPAC Name: (4-methylpiperazin-4-ium-1-yl)-(4-pyrrol-1-ylphenyl)methanone Traditional Name: (4-methylpiperazin-4-ium-1-yl)-(4-pyrrol-1-ylphenyl)methanone Formula: C16H20N3O+ MolecularWeight: 270.3495

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)N3C=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)N3C=CC=C3

InChI

InChI=1S/C16H19N3O/c1-17-10-12-19(13-11-17)16(20)14-4-6-15(7-5-14)18-8-2-3-9-18/h2-9H,10-13H2,1H3/p+1