2-(1,2-benzoxazol-3-yl)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-(1,2-benzoxazol-3-yl)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]ethanamide Openeye Name: 2-(1,2-benzoxazol-3-yl)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]acetamide CAS Name: 2-(1,2-benzoxazol-3-yl)-N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]acetamide IUPAC Name: 2-(1,2-benzoxazol-3-yl)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]acetamide Traditional Name: N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-2-indoxazen-3-yl-acetamide Formula: C21H23ClN3O2+ MolecularWeight: 384.87922

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CC2=NOC3=CC=CC=C32)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CC2=NOC3=CC=CC=C32)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O2/c22-16-7-5-15(6-8-16)14-25-11-9-17(10-12-25)23-21(26)13-19-18-3-1-2-4-20(18)27-24-19/h1-8,17H,9-14H2,(H,23,26)/p+1