N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[4-(furan-2-ylmethyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[4-(furan-2-ylmethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-[4-(2-furylmethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-[4-(2-furanylmethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-[4-(furan-2-ylmethyl)piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-[4-(2-furfuryl)piperazine-1,4-diium-1-yl]acetamide Formula: C19H26ClN3O4+2 MolecularWeight: 395.88044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CO3)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CO3)OC)Cl

InChI

InChI=1S/C19H24ClN3O4/c1-25-17-11-16(18(26-2)10-15(17)20)21-19(24)13-23-7-5-22(6-8-23)12-14-4-3-9-27-14/h3-4,9-11H,5-8,12-13H2,1-2H3,(H,21,24)/p+2