2-[3-[6-[(phenylmethyl)sulfonylamino]naphthalen-2-yl]propanoylamino]benzoic acid

Systemtic Name: 2-[3-[6-[(phenylmethyl)sulfonylamino]naphthalen-2-yl]propanoylamino]benzoic acid Openeye Name: 2-[3-[6-(benzylsulfonylamino)-2-naphthyl]propanoylamino]benzoic acid CAS Name: 2-[[1-oxo-3-[6-[(phenylmethyl)sulfonylamino]-2-naphthalenyl]propyl]amino]benzoic acid IUPAC Name: 2-[3-[6-(benzylsulfonylamino)naphthalen-2-yl]propanoylamino]benzoic acid Traditional Name: 2-[3-[6-(benzylsulfonylamino)-2-naphthyl]propanoylamino]benzoic acid Formula: C27H24N2O5S MolecularWeight: 488.55486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)NC2=CC3=C(C=C2)C=C(C=C3)CCC(=O)NC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)NC2=CC3=C(C=C2)C=C(C=C3)CCC(=O)NC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C27H24N2O5S/c30-26(28-25-9-5-4-8-24(25)27(31)32)15-11-19-10-12-22-17-23(14-13-21(22)16-19)29-35(33,34)18-20-6-2-1-3-7-20/h1-10,12-14,16-17,29H,11,15,18H2,(H,28,30)(H,31,32)