(2-phenethylphenyl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: (2-phenethylphenyl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: (2-phenethylphenyl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: (2-phenethylphenyl)-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: (2-phenethylphenyl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: (2-phenethylphenyl)-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C24H26N3O+ MolecularWeight: 372.48274

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC=CC=C3CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC=CC=C3CCC4=CC=CC=C4

InChI

InChI=1S/C24H25N3O/c28-24(27-18-16-26(17-19-27)23-12-6-7-15-25-23)22-11-5-4-10-21(22)14-13-20-8-2-1-3-9-20/h1-12,15H,13-14,16-19H2/p+1