N-(1,3-benzodioxol-5-yl)-1-[(4-chloranyl-1-oxidanyl-naphthalen-2-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[(4-chloranyl-1-oxidanyl-naphthalen-2-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[(4-chloro-1-hydroxy-2-naphthyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(4-chloro-1-hydroxy-2-naphthalenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[(4-chloro-1-hydroxynaphthalen-2-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[(4-chloro-1-hydroxy-2-naphthyl)methyl]piperidin-1-ium-4-carboxamide Formula: C24H24ClN2O4+ MolecularWeight: 439.91136

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC3=C(C=C2)OCO3)CC4=C(C5=CC=CC=C5C(=C4)Cl)O

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC3=C(C=C2)OCO3)CC4=C(C5=CC=CC=C5C(=C4)Cl)O

InChI

InChI=1S/C24H23ClN2O4/c25-20-11-16(23(28)19-4-2-1-3-18(19)20)13-27-9-7-15(8-10-27)24(29)26-17-5-6-21-22(12-17)31-14-30-21/h1-6,11-12,15,28H,7-10,13-14H2,(H,26,29)/p+1