dimethyl-[2-[4-(4-phenylphenyl)carbonylpiperazin-1-ium-1-yl]ethyl]azanium

Systemtic Name: dimethyl-[2-[4-(4-phenylphenyl)carbonylpiperazin-1-ium-1-yl]ethyl]azanium Openeye Name: dimethyl-[2-[4-(4-phenylbenzoyl)piperazin-1-ium-1-yl]ethyl]ammonium CAS Name: dimethyl-[2-[4-[oxo-(4-phenylphenyl)methyl]-1-piperazin-1-iumyl]ethyl]ammonium IUPAC Name: dimethyl-[2-[4-(4-phenylbenzoyl)piperazin-1-ium-1-yl]ethyl]azanium Traditional Name: dimethyl-[2-[4-(4-phenylbenzoyl)piperazin-1-ium-1-yl]ethyl]ammonium Formula: C21H29N3O+2 MolecularWeight: 339.47446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O/c1-22(2)12-13-23-14-16-24(17-15-23)21(25)20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11H,12-17H2,1-2H3/p+2