N-[2-(3-methylphenoxy)ethyl]-4-phenethyl-piperazin-4-ium-1-carboxamide

Systemtic Name: N-[2-(3-methylphenoxy)ethyl]-4-phenethyl-piperazin-4-ium-1-carboxamide Openeye Name: N-[2-(3-methylphenoxy)ethyl]-4-phenethyl-piperazin-4-ium-1-carboxamide CAS Name: N-[2-(3-methylphenoxy)ethyl]-4-phenethyl-1-piperazin-4-iumcarboxamide IUPAC Name: N-[2-(3-methylphenoxy)ethyl]-4-phenethylpiperazin-4-ium-1-carboxamide Traditional Name: N-[2-(3-methylphenoxy)ethyl]-4-phenethyl-piperazin-4-ium-1-carboxamide Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O2/c1-19-6-5-9-21(18-19)27-17-11-23-22(26)25-15-13-24(14-16-25)12-10-20-7-3-2-4-8-20/h2-9,18H,10-17H2,1H3,(H,23,26)/p+1