2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-furylmethyl)acetamide CAS Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(2-furanylmethyl)acetamide IUPAC Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(furan-2-ylmethyl)acetamide Traditional Name: N-(2-furfuryl)-2-(4-veratrylpiperazine-1,4-diium-1-yl)acetamide Formula: C20H29N3O4+2 MolecularWeight: 375.46196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NCC3=CC=CO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NCC3=CC=CO3)OC

InChI

InChI=1S/C20H27N3O4/c1-25-18-6-5-16(12-19(18)26-2)14-22-7-9-23(10-8-22)15-20(24)21-13-17-4-3-11-27-17/h3-6,11-12H,7-10,13-15H2,1-2H3,(H,21,24)/p+2