5-chloranyl-2-[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]ethoxy]benzamide

Systemtic Name: 5-chloranyl-2-[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]ethoxy]benzamide Openeye Name: 2-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-oxo-ethoxy]-5-chloro-benzamide CAS Name: 5-chloro-2-[2-oxo-2-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]ethoxy]benzamide IUPAC Name: 2-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-oxoethoxy]-5-chlorobenzamide Traditional Name: 2-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-keto-ethoxy]-5-chloro-benzamide Formula: C21H25ClN3O3+ MolecularWeight: 402.8945

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)COC2=C(C=C(C=C2)Cl)C(=O)N)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NC(=O)COC2=C(C=C(C=C2)Cl)C(=O)N)CC3=CC=CC=C3

InChI

InChI=1S/C21H24ClN3O3/c22-16-6-7-19(18(12-16)21(23)27)28-14-20(26)24-17-8-10-25(11-9-17)13-15-4-2-1-3-5-15/h1-7,12,17H,8-11,13-14H2,(H2,23,27)(H,24,26)/p+1