methyl-[2-oxidanyl-5-[3-oxidanylidene-3-(4-phenylbutylamino)-1-(phenylsulfonylamino)propyl]phenyl]carbamic acid

Systemtic Name: methyl-[2-oxidanyl-5-[3-oxidanylidene-3-(4-phenylbutylamino)-1-(phenylsulfonylamino)propyl]phenyl]carbamic acid Openeye Name: [5-[1-(benzenesulfonamido)-3-oxo-3-(4-phenylbutylamino)propyl]-2-hydroxy-phenyl]-methyl-carbamic acid CAS Name: [5-[1-(benzenesulfonamido)-3-oxo-3-(4-phenylbutylamino)propyl]-2-hydroxyphenyl]-methylcarbamic acid IUPAC Name: [5-[1-(benzenesulfonamido)-3-oxo-3-(4-phenylbutylamino)propyl]-2-hydroxyphenyl]-methylcarbamic acid Traditional Name: [5-[1-(benzenesulfonamido)-3-keto-3-(4-phenylbutylamino)propyl]-2-hydroxy-phenyl]-methyl-carbamic acid Formula: C27H31N3O6S MolecularWeight: 525.61654

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(C=CC(=C1)C(CC(=O)NCCCCC2=CC=CC=C2)NS(=O)(=O)C3=CC=CC=C3)O)C(=O)O

Isomeric SMILES

CN(C1=C(C=CC(=C1)C(CC(=O)NCCCCC2=CC=CC=C2)NS(=O)(=O)C3=CC=CC=C3)O)C(=O)O

InChI

InChI=1S/C27H31N3O6S/c1-30(27(33)34)24-18-21(15-16-25(24)31)23(29-37(35,36)22-13-6-3-7-14-22)19-26(32)28-17-9-8-12-20-10-4-2-5-11-20/h2-7,10-11,13-16,18,23,29,31H,8-9,12,17,19H2,1H3,(H,28,32)(H,33,34)