4-methyl-3-(phenylmethoxycarbonylamino)benzenesulfonic acid

Systemtic Name: 4-methyl-3-(phenylmethoxycarbonylamino)benzenesulfonic acid Openeye Name: 3-(benzyloxycarbonylamino)-4-methyl-benzenesulfonic acid CAS Name: 4-methyl-3-(phenylmethoxycarbonylamino)benzenesulfonic acid IUPAC Name: 4-methyl-3-(phenylmethoxycarbonylamino)benzenesulfonic acid Traditional Name: 3-(benzyloxycarbonylamino)-4-methyl-besylic acid Formula: C15H15NO5S MolecularWeight: 321.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C15H15NO5S/c1-11-7-8-13(22(18,19)20)9-14(11)16-15(17)21-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,16,17)(H,18,19,20)