N-[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C23H28ClN2O3+ MolecularWeight: 415.93302

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NCCC3=CC4=C(C(=C3)Cl)OCCO4

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NCCC3=CC4=C(C(=C3)Cl)OCCO4

InChI

InChI=1S/C23H27ClN2O3/c24-20-14-18(15-21-22(20)29-13-12-28-21)8-9-25-23(27)19-6-4-17(5-7-19)16-26-10-2-1-3-11-26/h4-7,14-15H,1-3,8-13,16H2,(H,25,27)/p+1