5-[[3-[(3-chlorophenyl)carbonylamino]-5-[(6-oxidanylnaphthalen-1-yl)carbamoyl]phenyl]carbonylamino]naphthalene-2-sulfonic acid

Systemtic Name: 5-[[3-[(3-chlorophenyl)carbonylamino]-5-[(6-oxidanylnaphthalen-1-yl)carbamoyl]phenyl]carbonylamino]naphthalene-2-sulfonic acid Openeye Name: 5-[[3-[(3-chlorobenzoyl)amino]-5-[(6-hydroxy-1-naphthyl)carbamoyl]benzoyl]amino]naphthalene-2-sulfonic acid CAS Name: 5-[[[3-[[(3-chlorophenyl)-oxomethyl]amino]-5-[[(6-hydroxy-1-naphthalenyl)amino]-oxomethyl]phenyl]-oxomethyl]amino]-2-naphthalenesulfonic acid IUPAC Name: 5-[[3-[(3-chlorobenzoyl)amino]-5-[(6-hydroxynaphthalen-1-yl)carbamoyl]benzoyl]amino]naphthalene-2-sulfonic acid Traditional Name: 5-[[3-[(3-chlorobenzoyl)amino]-5-[(6-hydroxy-1-naphthyl)carbamoyl]benzoyl]amino]naphthalene-2-sulfonic acid Formula: C35H24ClN3O7S MolecularWeight: 666.09896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(=O)NC2=CC(=CC(=C2)C(=O)NC3=CC=CC4=C3C=CC(=C4)S(=O)(=O)O)C(=O)NC5=CC=CC6=C5C=CC(=C6)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(=O)NC2=CC(=CC(=C2)C(=O)NC3=CC=CC4=C3C=CC(=C4)S(=O)(=O)O)C(=O)NC5=CC=CC6=C5C=CC(=C6)O

InChI

InChI=1S/C35H24ClN3O7S/c36-25-7-1-6-22(15-25)33(41)37-26-16-23(34(42)38-31-8-2-4-20-18-27(40)10-12-29(20)31)14-24(17-26)35(43)39-32-9-3-5-21-19-28(47(44,45)46)11-13-30(21)32/h1-19,40H,(H,37,41)(H,38,42)(H,39,43)(H,44,45,46)