5-[2-(1-methylpiperazin-1-ium-1-yl)ethyl-phenyl-amino]-1-phenyl-pentan-2-one

Systemtic Name: 5-[2-(1-methylpiperazin-1-ium-1-yl)ethyl-phenyl-amino]-1-phenyl-pentan-2-one Openeye Name: 5-[N-[2-(1-methylpiperazin-1-ium-1-yl)ethyl]anilino]-1-phenyl-pentan-2-one CAS Name: 5-[N-[2-(1-methyl-1-piperazin-1-iumyl)ethyl]anilino]-1-phenyl-2-pentanone IUPAC Name: 5-[N-[2-(1-methylpiperazin-1-ium-1-yl)ethyl]anilino]-1-phenylpentan-2-one Traditional Name: 5-[N-[2-(1-methylpiperazin-1-ium-1-yl)ethyl]anilino]-1-phenyl-pentan-2-one Formula: C24H34N3O+ MolecularWeight: 380.54626

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)CCN(CCCC(=O)CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[N+]1(CCNCC1)CCN(CCCC(=O)CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H34N3O/c1-27(18-14-25-15-19-27)20-17-26(23-11-6-3-7-12-23)16-8-13-24(28)21-22-9-4-2-5-10-22/h2-7,9-12,25H,8,13-21H2,1H3/q+1