2-methyl-5-oxidanyl-N-(4-propan-2-ylphenyl)-4-(pyrrolidin-1-ium-1-ylmethyl)-1-benzofuran-3-carboxamide

Systemtic Name: 2-methyl-5-oxidanyl-N-(4-propan-2-ylphenyl)-4-(pyrrolidin-1-ium-1-ylmethyl)-1-benzofuran-3-carboxamide Openeye Name: 5-hydroxy-N-(4-isopropylphenyl)-2-methyl-4-(pyrrolidin-1-ium-1-ylmethyl)benzofuran-3-carboxamide CAS Name: 5-hydroxy-2-methyl-N-(4-propan-2-ylphenyl)-4-(1-pyrrolidin-1-iumylmethyl)-3-benzofurancarboxamide IUPAC Name: 5-hydroxy-2-methyl-N-(4-propan-2-ylphenyl)-4-(pyrrolidin-1-ium-1-ylmethyl)-1-benzofuran-3-carboxamide Traditional Name: 5-hydroxy-2-methyl-N-p-cumenyl-4-(pyrrolidin-1-ium-1-ylmethyl)benzofuran-3-carboxamide Formula: C24H29N2O3+ MolecularWeight: 393.49866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2C[NH+]3CCCC3)O)C(=O)NC4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2C[NH+]3CCCC3)O)C(=O)NC4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C24H28N2O3/c1-15(2)17-6-8-18(9-7-17)25-24(28)22-16(3)29-21-11-10-20(27)19(23(21)22)14-26-12-4-5-13-26/h6-11,15,27H,4-5,12-14H2,1-3H3,(H,25,28)/p+1