(2R)-2-(3-chloranylphenoxy)-N-[2-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]propanamide

Systemtic Name: (2R)-2-(3-chloranylphenoxy)-N-[2-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]propanamide Openeye Name: (2R)-2-(3-chlorophenoxy)-N-[2-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]propanamide CAS Name: (2R)-2-(3-chlorophenoxy)-N-[2-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]propanamide IUPAC Name: (2R)-2-(3-chlorophenoxy)-N-[2-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]propanamide Traditional Name: (2R)-2-(3-chlorophenoxy)-N-[2-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]propionamide Formula: C21H25ClN3O3+ MolecularWeight: 402.8945

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(=O)N2CC[NH+](CC2)C)OC3=CC(=CC=C3)Cl

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C(=O)N2CC[NH+](CC2)C)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H24ClN3O3/c1-15(28-17-7-5-6-16(22)14-17)20(26)23-19-9-4-3-8-18(19)21(27)25-12-10-24(2)11-13-25/h3-9,14-15H,10-13H2,1-2H3,(H,23,26)/p+1/t15-/m1/s1