carbamimidoylazanium; (4-nitrophenyl)sulfonyl ethanoate

Systemtic Name: carbamimidoylazanium; (4-nitrophenyl)sulfonyl ethanoate Openeye Name: carbamimidoylammonium; (4-nitrophenyl)sulfonyl acetate CAS Name: acetic acid (4-nitrophenyl)sulfonyl ester; carbamimidoylammonium IUPAC Name: carbamimidoylazanium; (4-nitrophenyl)sulfonyl acetate Traditional Name: acetic acid nosyl ester; amidinoammonium Formula: C9H13N4O6S+ MolecularWeight: 305.28772

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-].C(=N)([NH3+])N

Isomeric SMILES

CC(=O)OS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-].C(=N)([NH3+])N

InChI

InChI=1S/C8H7NO6S.CH5N3/c1-6(10)15-16(13,14)8-4-2-7(3-5-8)9(11)12;2-1(3)4/h2-5H,1H3;(H5,2,3,4)/p+1