N-[(2R)-2-(4-chlorophenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-3-propoxy-benzamide

Systemtic Name: N-[(2R)-2-(4-chlorophenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-3-propoxy-benzamide Openeye Name: N-[(2R)-2-(4-chlorophenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-3-propoxy-benzamide CAS Name: N-[(2R)-2-(4-chlorophenyl)-2-(4-methyl-1-piperazin-4-iumyl)ethyl]-3-propoxybenzamide IUPAC Name: N-[(2R)-2-(4-chlorophenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-3-propoxybenzamide Traditional Name: N-[(2R)-2-(4-chlorophenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-3-propoxy-benzamide Formula: C23H31ClN3O2+ MolecularWeight: 416.96414

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NCC(C2=CC=C(C=C2)Cl)N3CC[NH+](CC3)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC[C@@H](C2=CC=C(C=C2)Cl)N3CC[NH+](CC3)C

InChI

InChI=1S/C23H30ClN3O2/c1-3-15-29-21-6-4-5-19(16-21)23(28)25-17-22(18-7-9-20(24)10-8-18)27-13-11-26(2)12-14-27/h4-10,16,22H,3,11-15,17H2,1-2H3,(H,25,28)/p+1/t22-/m0/s1