N-[3-chloranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,4,5-triethoxy-benzamide

Systemtic Name: N-[3-chloranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,4,5-triethoxy-benzamide Openeye Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,4,5-triethoxy-benzamide CAS Name: N-[3-chloro-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3,4,5-triethoxybenzamide IUPAC Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,4,5-triethoxybenzamide Traditional Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,4,5-triethoxy-benzamide Formula: C24H33ClN3O4+ MolecularWeight: 462.98952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC(=C(C=C2)N3CC[NH+](CC3)C)Cl

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC(=C(C=C2)N3CC[NH+](CC3)C)Cl

InChI

InChI=1S/C24H32ClN3O4/c1-5-30-21-14-17(15-22(31-6-2)23(21)32-7-3)24(29)26-18-8-9-20(19(25)16-18)28-12-10-27(4)11-13-28/h8-9,14-16H,5-7,10-13H2,1-4H3,(H,26,29)/p+1