N-[4,4-bis(4-chlorophenyl)-4-oxidanyl-but-2-ynyl]-4-methyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-[4,4-bis(4-chlorophenyl)-4-oxidanyl-but-2-ynyl]-4-methyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-N-[4,4-bis(4-chlorophenyl)-4-hydroxy-but-2-ynyl]-4-methyl-benzenesulfonamide CAS Name: N-[4,4-bis(4-chlorophenyl)-4-hydroxybut-2-ynyl]-4-methyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-[4,4-bis(4-chlorophenyl)-4-hydroxybut-2-ynyl]-4-methylbenzenesulfonamide Traditional Name: N-benzyl-N-[4,4-bis(4-chlorophenyl)-4-hydroxy-but-2-ynyl]-4-methyl-benzenesulfonamide Formula: C30H25Cl2NO3S MolecularWeight: 550.4954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC#CC(C2=CC=C(C=C2)Cl)(C3=CC=C(C=C3)Cl)O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC#CC(C2=CC=C(C=C2)Cl)(C3=CC=C(C=C3)Cl)O)CC4=CC=CC=C4

InChI

InChI=1S/C30H25Cl2NO3S/c1-23-8-18-29(19-9-23)37(35,36)33(22-24-6-3-2-4-7-24)21-5-20-30(34,25-10-14-27(31)15-11-25)26-12-16-28(32)17-13-26/h2-4,6-19,34H,21-22H2,1H3