5-chloranyl-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-chloranyl-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]-1-benzofuran-2-carboxamide Openeye Name: 5-chloro-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]benzofuran-2-carboxamide CAS Name: 5-chloro-N-[(1R)-1-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]-2-benzofurancarboxamide IUPAC Name: 5-chloro-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]-1-benzofuran-2-carboxamide Traditional Name: 5-chloro-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]coumarilamide Formula: C22H24ClN2O3+ MolecularWeight: 399.89056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[NH+]2CCOCC2)NC(=O)C3=CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[NH+]2CCOCC2)NC(=O)C3=CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C22H23ClN2O3/c1-15-2-4-16(5-3-15)19(14-25-8-10-27-11-9-25)24-22(26)21-13-17-12-18(23)6-7-20(17)28-21/h2-7,12-13,19H,8-11,14H2,1H3,(H,24,26)/p+1/t19-/m0/s1