6-chloranyl-3-[2-(4-cyclohexylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-chloranyl-3-[2-(4-cyclohexylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one Openeye Name: 6-chloro-3-[2-(4-cyclohexylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-1,3-benzoxazol-2-one CAS Name: 6-chloro-3-[2-(4-cyclohexyl-1-piperazin-4-iumyl)-2-oxoethyl]-1,3-benzoxazol-2-one IUPAC Name: 6-chloro-3-[2-(4-cyclohexylpiperazin-4-ium-1-yl)-2-oxoethyl]-1,3-benzoxazol-2-one Traditional Name: 6-chloro-3-[2-(4-cyclohexylpiperazin-4-ium-1-yl)-2-keto-ethyl]-1,3-benzoxazol-2-one Formula: C19H25ClN3O3+ MolecularWeight: 378.8731

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCN(CC2)C(=O)CN3C4=C(C=C(C=C4)Cl)OC3=O

Isomeric SMILES

C1CCC(CC1)[NH+]2CCN(CC2)C(=O)CN3C4=C(C=C(C=C4)Cl)OC3=O

InChI

InChI=1S/C19H24ClN3O3/c20-14-6-7-16-17(12-14)26-19(25)23(16)13-18(24)22-10-8-21(9-11-22)15-4-2-1-3-5-15/h6-7,12,15H,1-5,8-11,13H2/p+1