4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-2-methyl-5-oxidanyl-N-(phenylmethyl)-1-benzofuran-3-carboxamide

Systemtic Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-2-methyl-5-oxidanyl-N-(phenylmethyl)-1-benzofuran-3-carboxamide Openeye Name: N-benzyl-4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-5-hydroxy-2-methyl-benzofuran-3-carboxamide CAS Name: 4-[(4-ethyl-1-piperazine-1,4-diiumyl)methyl]-5-hydroxy-2-methyl-N-(phenylmethyl)-3-benzofurancarboxamide IUPAC Name: N-benzyl-4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide Traditional Name: N-benzyl-4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-5-hydroxy-2-methyl-benzofuran-3-carboxamide Formula: C24H31N3O3+2 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC2=C(C=CC3=C2C(=C(O3)C)C(=O)NCC4=CC=CC=C4)O

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC2=C(C=CC3=C2C(=C(O3)C)C(=O)NCC4=CC=CC=C4)O

InChI

InChI=1S/C24H29N3O3/c1-3-26-11-13-27(14-12-26)16-19-20(28)9-10-21-23(19)22(17(2)30-21)24(29)25-15-18-7-5-4-6-8-18/h4-10,28H,3,11-16H2,1-2H3,(H,25,29)/p+2