phenyl 3-(2-azanylethanoylamino)benzenesulfonate

Systemtic Name: phenyl 3-(2-azanylethanoylamino)benzenesulfonate Openeye Name: phenyl 3-[(2-aminoacetyl)amino]benzenesulfonate CAS Name: 3-[(2-amino-1-oxoethyl)amino]benzenesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(2-aminoacetyl)amino]benzenesulfonate Traditional Name: 3-(glycylamino)benzenesulfonic acid phenyl ester Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)NC(=O)CN

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)NC(=O)CN

InChI

InChI=1S/C14H14N2O4S/c15-10-14(17)16-11-5-4-8-13(9-11)21(18,19)20-12-6-2-1-3-7-12/h1-9H,10,15H2,(H,16,17)