N-[3-chloranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-ethoxy-benzamide

Systemtic Name: N-[3-chloranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-ethoxy-benzamide Openeye Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-ethoxy-benzamide CAS Name: N-[3-chloro-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-ethoxybenzamide IUPAC Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-ethoxybenzamide Traditional Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-ethoxy-benzamide Formula: C20H25ClN3O2+ MolecularWeight: 374.8844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)NC2=CC(=C(C=C2)N3CC[NH+](CC3)C)Cl

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)NC2=CC(=C(C=C2)N3CC[NH+](CC3)C)Cl

InChI

InChI=1S/C20H24ClN3O2/c1-3-26-17-6-4-5-15(13-17)20(25)22-16-7-8-19(18(21)14-16)24-11-9-23(2)10-12-24/h4-8,13-14H,3,9-12H2,1-2H3,(H,22,25)/p+1