phosphoric acid; N-(2-piperazin-1-ylcarbonylphenyl)methanesulfonamide

Systemtic Name: phosphoric acid; N-(2-piperazin-1-ylcarbonylphenyl)methanesulfonamide Openeye Name: phosphoric acid; N-[2-(piperazine-1-carbonyl)phenyl]methanesulfonamide CAS Name: N-[2-[oxo(1-piperazinyl)methyl]phenyl]methanesulfonamide; phosphoric acid IUPAC Name: phosphoric acid; N-[2-(piperazine-1-carbonyl)phenyl]methanesulfonamide Traditional Name: phosphoric acid; N-[2-(piperazine-1-carbonyl)phenyl]methanesulfonamide Formula: C12H20N3O7PS MolecularWeight: 381.341861

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC=C1C(=O)N2CCNCC2.OP(=O)(O)O

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC=C1C(=O)N2CCNCC2.OP(=O)(O)O

InChI

InChI=1S/C12H17N3O3S.H3O4P/c1-19(17,18)14-11-5-3-2-4-10(11)12(16)15-8-6-13-7-9-15;1-5(2,3)4/h2-5,13-14H,6-9H2,1H3;(H3,1,2,3,4)