N-[4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]phenyl]ethanamide

Systemtic Name: N-[4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]phenyl]ethanamide Openeye Name: N-[4-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxo-ethyl]phenyl]acetamide CAS Name: N-[4-[2-oxo-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethyl]phenyl]acetamide IUPAC Name: N-[4-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxoethyl]phenyl]acetamide Traditional Name: N-[4-[2-(4-benzylpiperazin-4-ium-1-yl)-2-keto-ethyl]phenyl]acetamide Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2/c1-17(25)22-20-9-7-18(8-10-20)15-21(26)24-13-11-23(12-14-24)16-19-5-3-2-4-6-19/h2-10H,11-16H2,1H3,(H,22,25)/p+1