bis(azanyl)methylideneazanium; 2-(phenylsulfonyl)ethanoate

Systemtic Name: bis(azanyl)methylideneazanium; 2-(phenylsulfonyl)ethanoate Openeye Name: 2-(benzenesulfonyl)acetate; diaminomethyleneammonium CAS Name: 2-(benzenesulfonyl)acetate; diaminomethylideneammonium IUPAC Name: 2-(benzenesulfonyl)acetate; diaminomethylideneazanium Traditional Name: 2-besylacetate; diaminomethyleneammonium Formula: C9H13N3O4S MolecularWeight: 259.28222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CC(=O)[O-].C(=[NH2+])(N)N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CC(=O)[O-].C(=[NH2+])(N)N

InChI

InChI=1S/C8H8O4S.CH5N3/c9-8(10)6-13(11,12)7-4-2-1-3-5-7;2-1(3)4/h1-5H,6H2,(H,9,10);(H5,2,3,4)