2-azanyl-4-(4-methoxyphenyl)sulfonyl-3-phenylmethoxy-5-(phenylmethyl)benzoic acid

Systemtic Name: 2-azanyl-4-(4-methoxyphenyl)sulfonyl-3-phenylmethoxy-5-(phenylmethyl)benzoic acid Openeye Name: 2-amino-5-benzyl-3-benzyloxy-4-(4-methoxyphenyl)sulfonyl-benzoic acid CAS Name: 2-amino-4-(4-methoxyphenyl)sulfonyl-3-phenylmethoxy-5-(phenylmethyl)benzoic acid IUPAC Name: 2-amino-5-benzyl-4-(4-methoxyphenyl)sulfonyl-3-phenylmethoxybenzoic acid Traditional Name: 2-amino-3-benzoxy-5-benzyl-4-(4-methoxyphenyl)sulfonyl-benzoic acid Formula: C28H25NO6S MolecularWeight: 503.5662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C(=C2OCC3=CC=CC=C3)N)C(=O)O)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C(=C2OCC3=CC=CC=C3)N)C(=O)O)CC4=CC=CC=C4

InChI

InChI=1S/C28H25NO6S/c1-34-22-12-14-23(15-13-22)36(32,33)27-21(16-19-8-4-2-5-9-19)17-24(28(30)31)25(29)26(27)35-18-20-10-6-3-7-11-20/h2-15,17H,16,18,29H2,1H3,(H,30,31)