3-methyl-N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]butanamide

Systemtic Name: 3-methyl-N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]butanamide Openeye Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-3-methyl-butanamide CAS Name: 3-methyl-N-[4-[4-(phenylmethyl)-1-piperazin-4-iumyl]phenyl]butanamide IUPAC Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-3-methylbutanamide Traditional Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-3-methyl-butyramide Formula: C22H30N3O+ MolecularWeight: 352.4931

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O/c1-18(2)16-22(26)23-20-8-10-21(11-9-20)25-14-12-24(13-15-25)17-19-6-4-3-5-7-19/h3-11,18H,12-17H2,1-2H3,(H,23,26)/p+1