2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-methyl-ethanamide Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-N-methyl-acetamide CAS Name: 2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-methylacetamide IUPAC Name: 2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-methylacetamide Traditional Name: N-(4-benzoxy-3-methoxy-benzyl)-2-[4-(2-furoyl)piperazin-1-ium-1-yl]-N-methyl-acetamide Formula: C27H32N3O5+ MolecularWeight: 478.56008

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C27H31N3O5/c1-28(26(31)19-29-12-14-30(15-13-29)27(32)24-9-6-16-34-24)18-22-10-11-23(25(17-22)33-2)35-20-21-7-4-3-5-8-21/h3-11,16-17H,12-15,18-20H2,1-2H3/p+1