N-[1,1-bis(4-dimethylaminophenyl)-3-oxidanylidene-2-benzofuran-5-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[1,1-bis(4-dimethylaminophenyl)-3-oxidanylidene-2-benzofuran-5-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[1,1-bis(4-dimethylaminophenyl)-3-oxo-isobenzofuran-5-yl]-4-methyl-benzenesulfonamide CAS Name: N-[1,1-bis(4-dimethylaminophenyl)-3-oxo-5-isobenzofuranyl]-4-methylbenzenesulfonamide IUPAC Name: N-[1,1-bis(4-dimethylaminophenyl)-3-oxo-2-benzofuran-5-yl]-4-methylbenzenesulfonamide Traditional Name: N-[1,1-bis(4-dimethylaminophenyl)-3-keto-phthalan-5-yl]-4-methyl-benzenesulfonamide Formula: C31H31N3O4S MolecularWeight: 541.66054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)C(OC3=O)(C4=CC=C(C=C4)N(C)C)C5=CC=C(C=C5)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)C(OC3=O)(C4=CC=C(C=C4)N(C)C)C5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C31H31N3O4S/c1-21-6-17-27(18-7-21)39(36,37)32-24-12-19-29-28(20-24)30(35)38-31(29,22-8-13-25(14-9-22)33(2)3)23-10-15-26(16-11-23)34(4)5/h6-20,32H,1-5H3