[4-(phenylmethyl)piperazin-4-ium-1-yl]-(4-pyrrol-1-ylphenyl)methanone

Systemtic Name: [4-(phenylmethyl)piperazin-4-ium-1-yl]-(4-pyrrol-1-ylphenyl)methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-(4-pyrrol-1-ylphenyl)methanone CAS Name: [4-(phenylmethyl)-1-piperazin-4-iumyl]-[4-(1-pyrrolyl)phenyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-(4-pyrrol-1-ylphenyl)methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-(4-pyrrol-1-ylphenyl)methanone Formula: C22H24N3O+ MolecularWeight: 346.44546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)N4C=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C22H23N3O/c26-22(20-8-10-21(11-9-20)24-12-4-5-13-24)25-16-14-23(15-17-25)18-19-6-2-1-3-7-19/h1-13H,14-18H2/p+1