N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C21H25N2O3+ MolecularWeight: 353.4348

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H24N2O3/c24-21(22-18-8-9-19-20(14-18)26-13-12-25-19)17-6-4-16(5-7-17)15-23-10-2-1-3-11-23/h4-9,14H,1-3,10-13,15H2,(H,22,24)/p+1