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

Systemtic Name: N-[3-chloranyl-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[3-chloro-4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4,5-trimethoxy-benzamide Formula: C22H29ClN3O4+ MolecularWeight: 434.93636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28ClN3O4/c1-5-25-8-10-26(11-9-25)18-7-6-16(14-17(18)23)24-22(27)15-12-19(28-2)21(30-4)20(13-15)29-3/h6-7,12-14H,5,8-11H2,1-4H3,(H,24,27)/p+1