4-[(7-chloranyl-2H-chromen-3-yl)sulfonyl]-1-(piperidin-4-ylideneamino)-1-pyridin-4-yl-piperazin-1-ium-2-one

Systemtic Name: 4-[(7-chloranyl-2H-chromen-3-yl)sulfonyl]-1-(piperidin-4-ylideneamino)-1-pyridin-4-yl-piperazin-1-ium-2-one Openeye Name: 4-[(7-chloro-2H-chromen-3-yl)sulfonyl]-1-(4-piperidylideneamino)-1-(4-pyridyl)piperazin-1-ium-2-one CAS Name: 4-[(7-chloro-2H-1-benzopyran-3-yl)sulfonyl]-1-(4-piperidinylideneamino)-1-pyridin-4-yl-2-piperazin-1-iumone IUPAC Name: 4-[(7-chloro-2H-chromen-3-yl)sulfonyl]-1-(piperidin-4-ylideneamino)-1-pyridin-4-ylpiperazin-1-ium-2-one Traditional Name: 4-[(7-chloro-2H-chromen-3-yl)sulfonyl]-1-(4-piperidylideneamino)-1-(4-pyridyl)piperazin-1-ium-2-one Formula: C23H25ClN5O4S+ MolecularWeight: 502.9937

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1=N[N+]2(CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C(C=C4)Cl)OC3)C5=CC=NC=C5

Isomeric SMILES

C1CNCCC1=N[N+]2(CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C(C=C4)Cl)OC3)C5=CC=NC=C5

InChI

InChI=1S/C23H25ClN5O4S/c24-18-2-1-17-13-21(16-33-22(17)14-18)34(31,32)28-11-12-29(23(30)15-28,20-5-9-26-10-6-20)27-19-3-7-25-8-4-19/h1-2,5-6,9-10,13-14,25H,3-4,7-8,11-12,15-16H2/q+1