methyl-[3-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonylamino]propyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[3-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonylamino]propyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]propyl]ammonium CAS Name: methyl-[3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]propyl]azanium Traditional Name: benzyl-[3-[(2-keto-3H-1,3-benzoxazol-6-yl)sulfonylamino]propyl]-methyl-ammonium Formula: C18H22N3O4S+ MolecularWeight: 376.44998

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNS(=O)(=O)C1=CC2=C(C=C1)NC(=O)O2)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](CCCNS(=O)(=O)C1=CC2=C(C=C1)NC(=O)O2)CC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O4S/c1-21(13-14-6-3-2-4-7-14)11-5-10-19-26(23,24)15-8-9-16-17(12-15)25-18(22)20-16/h2-4,6-9,12,19H,5,10-11,13H2,1H3,(H,20,22)/p+1