N-(5-chloranyl-2-methyl-phenyl)-5-(piperidin-1-ium-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-5-(piperidin-1-ium-1-ylmethyl)furan-2-carboxamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-5-(piperidin-1-ium-1-ylmethyl)furan-2-carboxamide CAS Name: N-(5-chloro-2-methylphenyl)-5-(1-piperidin-1-iumylmethyl)-2-furancarboxamide IUPAC Name: N-(5-chloro-2-methylphenyl)-5-(piperidin-1-ium-1-ylmethyl)furan-2-carboxamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-5-(piperidin-1-ium-1-ylmethyl)-2-furamide Formula: C18H22ClN2O2+ MolecularWeight: 333.83248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)C2=CC=C(O2)C[NH+]3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)C2=CC=C(O2)C[NH+]3CCCCC3

InChI

InChI=1S/C18H21ClN2O2/c1-13-5-6-14(19)11-16(13)20-18(22)17-8-7-15(23-17)12-21-9-3-2-4-10-21/h5-8,11H,2-4,9-10,12H2,1H3,(H,20,22)/p+1