(4-chloranyl-2-ethoxycarbonyl-3-methyl-1-benzofuran-5-yl)methyl-cyclohexyl-azanium

Systemtic Name: (4-chloranyl-2-ethoxycarbonyl-3-methyl-1-benzofuran-5-yl)methyl-cyclohexyl-azanium Openeye Name: (4-chloro-2-ethoxycarbonyl-3-methyl-benzofuran-5-yl)methyl-cyclohexyl-ammonium CAS Name: (4-chloro-2-ethoxycarbonyl-3-methyl-5-benzofuranyl)methyl-cyclohexylammonium IUPAC Name: (4-chloro-2-ethoxycarbonyl-3-methyl-1-benzofuran-5-yl)methyl-cyclohexylazanium Traditional Name: (2-carbethoxy-4-chloro-3-methyl-benzofuran-5-yl)methyl-cyclohexyl-ammonium Formula: C19H25ClNO3+ MolecularWeight: 350.8597

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2Cl)C[NH2+]C3CCCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2Cl)C[NH2+]C3CCCCC3)C

InChI

InChI=1S/C19H24ClNO3/c1-3-23-19(22)18-12(2)16-15(24-18)10-9-13(17(16)20)11-21-14-7-5-4-6-8-14/h9-10,14,21H,3-8,11H2,1-2H3/p+1