4-[4-(1-benzamido-2-methoxy-2-oxidanylidene-ethyl)phenyl]benzenesulfonic acid

Systemtic Name: 4-[4-(1-benzamido-2-methoxy-2-oxidanylidene-ethyl)phenyl]benzenesulfonic acid Openeye Name: 4-[4-(1-benzamido-2-methoxy-2-oxo-ethyl)phenyl]benzenesulfonic acid CAS Name: 4-[4-(1-benzamido-2-methoxy-2-oxoethyl)phenyl]benzenesulfonic acid IUPAC Name: 4-[4-(1-benzamido-2-methoxy-2-oxoethyl)phenyl]benzenesulfonic acid Traditional Name: 4-[4-(1-benzamido-2-keto-2-methoxy-ethyl)phenyl]besylic acid Formula: C22H19NO6S MolecularWeight: 425.45436

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C(C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H19NO6S/c1-29-22(25)20(23-21(24)18-5-3-2-4-6-18)17-9-7-15(8-10-17)16-11-13-19(14-12-16)30(26,27)28/h2-14,20H,1H3,(H,23,24)(H,26,27,28)