N-[(2R)-2-(4-chlorophenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-2-propoxy-benzamide

Systemtic Name: N-[(2R)-2-(4-chlorophenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-2-propoxy-benzamide Openeye Name: N-[(2R)-2-(4-chlorophenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-2-propoxy-benzamide CAS Name: N-[(2R)-2-(4-chlorophenyl)-2-(4-methyl-1-piperazin-4-iumyl)ethyl]-2-propoxybenzamide IUPAC Name: N-[(2R)-2-(4-chlorophenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-2-propoxybenzamide Traditional Name: N-[(2R)-2-(4-chlorophenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-2-propoxy-benzamide Formula: C23H31ClN3O2+ MolecularWeight: 416.96414

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(=O)NCC(C2=CC=C(C=C2)Cl)N3CC[NH+](CC3)C

Isomeric SMILES

CCCOC1=CC=CC=C1C(=O)NC[C@@H](C2=CC=C(C=C2)Cl)N3CC[NH+](CC3)C

InChI

InChI=1S/C23H30ClN3O2/c1-3-16-29-22-7-5-4-6-20(22)23(28)25-17-21(18-8-10-19(24)11-9-18)27-14-12-26(2)13-15-27/h4-11,21H,3,12-17H2,1-2H3,(H,25,28)/p+1/t21-/m0/s1