2-azanyl-4-chloranyl-3-[[4-chloranyl-3-(phenylmethoxycarbonylamino)phenyl]sulfonylcarbamoyl]benzoic acid

Systemtic Name: 2-azanyl-4-chloranyl-3-[[4-chloranyl-3-(phenylmethoxycarbonylamino)phenyl]sulfonylcarbamoyl]benzoic acid Openeye Name: 2-amino-3-[[3-(benzyloxycarbonylamino)-4-chloro-phenyl]sulfonylcarbamoyl]-4-chloro-benzoic acid CAS Name: 2-amino-4-chloro-3-[[[4-chloro-3-(phenylmethoxycarbonylamino)phenyl]sulfonylamino]-oxomethyl]benzoic acid IUPAC Name: 2-amino-4-chloro-3-[[4-chloro-3-(phenylmethoxycarbonylamino)phenyl]sulfonylcarbamoyl]benzoic acid Traditional Name: 2-amino-3-[[3-(benzyloxycarbonylamino)-4-chloro-phenyl]sulfonylcarbamoyl]-4-chloro-benzoic acid Formula: C22H17Cl2N3O7S MolecularWeight: 538.35728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=C(C=CC(=C2)S(=O)(=O)NC(=O)C3=C(C=CC(=C3N)C(=O)O)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=C(C=CC(=C2)S(=O)(=O)NC(=O)C3=C(C=CC(=C3N)C(=O)O)Cl)Cl

InChI

InChI=1S/C22H17Cl2N3O7S/c23-15-8-6-13(10-17(15)26-22(31)34-11-12-4-2-1-3-5-12)35(32,33)27-20(28)18-16(24)9-7-14(19(18)25)21(29)30/h1-10H,11,25H2,(H,26,31)(H,27,28)(H,29,30)