[3-azanyl-4-(2-methoxyethanoylamino)phenyl] benzenesulfonate

Systemtic Name: [3-azanyl-4-(2-methoxyethanoylamino)phenyl] benzenesulfonate Openeye Name: [3-amino-4-[(2-methoxyacetyl)amino]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [3-amino-4-[(2-methoxy-1-oxoethyl)amino]phenyl] ester IUPAC Name: [3-amino-4-[(2-methoxyacetyl)amino]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [3-amino-4-[(2-methoxyacetyl)amino]phenyl] ester Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)NC1=C(C=C(C=C1)OS(=O)(=O)C2=CC=CC=C2)N

Isomeric SMILES

COCC(=O)NC1=C(C=C(C=C1)OS(=O)(=O)C2=CC=CC=C2)N

InChI

InChI=1S/C15H16N2O5S/c1-21-10-15(18)17-14-8-7-11(9-13(14)16)22-23(19,20)12-5-3-2-4-6-12/h2-9H,10,16H2,1H3,(H,17,18)