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

Systemtic Name: N-[3-chloranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethoxy-benzamide CAS Name: N-[3-chloro-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethoxybenzamide Traditional Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethoxy-benzamide Formula: C20H25ClN3O3+ MolecularWeight: 390.8838

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)OC)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)OC)Cl

InChI

InChI=1S/C20H24ClN3O3/c1-23-8-10-24(11-9-23)17-6-5-15(13-16(17)21)22-20(25)14-4-7-18(26-2)19(12-14)27-3/h4-7,12-13H,8-11H2,1-3H3,(H,22,25)/p+1