phenyl 2-(aminocarbonylamino)-4-azanyl-4-oxidanylidene-butane-2-sulfonate

Systemtic Name: phenyl 2-(aminocarbonylamino)-4-azanyl-4-oxidanylidene-butane-2-sulfonate Openeye Name: phenyl 4-amino-4-oxo-2-ureido-butane-2-sulfonate CAS Name: 4-amino-2-(carbamoylamino)-4-oxo-2-butanesulfonic acid IUPAC Name: phenyl 4-amino-2-(carbamoylamino)-4-oxobutane-2-sulfonate Traditional Name: 4-amino-4-keto-2-ureido-butane-2-sulfonic acid phenyl ester Formula: C11H15N3O5S MolecularWeight: 301.3189

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N)(NC(=O)N)S(=O)(=O)OC1=CC=CC=C1

Isomeric SMILES

CC(CC(=O)N)(NC(=O)N)S(=O)(=O)OC1=CC=CC=C1

InChI

InChI=1S/C11H15N3O5S/c1-11(7-9(12)15,14-10(13)16)20(17,18)19-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,12,15)(H3,13,14,16)