diethyl-[[2-methyl-3-[(2-methylphenyl)carbamoyl]-5-oxidanyl-1-benzofuran-4-yl]methyl]azanium

Systemtic Name: diethyl-[[2-methyl-3-[(2-methylphenyl)carbamoyl]-5-oxidanyl-1-benzofuran-4-yl]methyl]azanium Openeye Name: diethyl-[[5-hydroxy-2-methyl-3-(o-tolylcarbamoyl)benzofuran-4-yl]methyl]ammonium CAS Name: diethyl-[[5-hydroxy-2-methyl-3-[(2-methylanilino)-oxomethyl]-4-benzofuranyl]methyl]ammonium IUPAC Name: diethyl-[[5-hydroxy-2-methyl-3-[(2-methylphenyl)carbamoyl]-1-benzofuran-4-yl]methyl]azanium Traditional Name: diethyl-[[5-hydroxy-2-methyl-3-(o-tolylcarbamoyl)benzofuran-4-yl]methyl]ammonium Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC2=C1C(=C(O2)C)C(=O)NC3=CC=CC=C3C)O

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC2=C1C(=C(O2)C)C(=O)NC3=CC=CC=C3C)O

InChI

InChI=1S/C22H26N2O3/c1-5-24(6-2)13-16-18(25)11-12-19-21(16)20(15(4)27-19)22(26)23-17-10-8-7-9-14(17)3/h7-12,25H,5-6,13H2,1-4H3,(H,23,26)/p+1