1-(4-chlorophenyl)-2-[4-(5-methylbenzotriazol-1-yl)piperidin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-chlorophenyl)-2-[4-(5-methylbenzotriazol-1-yl)piperidin-1-ium-1-yl]ethanone Openeye Name: 1-(4-chlorophenyl)-2-[4-(5-methylbenzotriazol-1-yl)piperidin-1-ium-1-yl]ethanone CAS Name: 1-(4-chlorophenyl)-2-[4-(5-methyl-1-benzotriazolyl)-1-piperidin-1-iumyl]ethanone IUPAC Name: 1-(4-chlorophenyl)-2-[4-(5-methylbenzotriazol-1-yl)piperidin-1-ium-1-yl]ethanone Traditional Name: 1-(4-chlorophenyl)-2-[4-(5-methylbenzotriazol-1-yl)piperidin-1-ium-1-yl]ethanone Formula: C20H22ClN4O+ MolecularWeight: 369.86788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(N=N2)C3CC[NH+](CC3)CC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N(N=N2)C3CC[NH+](CC3)CC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H21ClN4O/c1-14-2-7-19-18(12-14)22-23-25(19)17-8-10-24(11-9-17)13-20(26)15-3-5-16(21)6-4-15/h2-7,12,17H,8-11,13H2,1H3/p+1