benzenesulfonic acid; N-[1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]piperidin-4-yl]-N-phenyl-benzenesulfonamide

Systemtic Name: benzenesulfonic acid; N-[1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]piperidin-4-yl]-N-phenyl-benzenesulfonamide Openeye Name: benzenesulfonic acid; N-[1-(2-chroman-4-ylethyl)-4-piperidyl]-N-phenyl-benzenesulfonamide CAS Name: benzenesulfonic acid; N-[1-[2-(3,4-dihydro-2H-1-benzopyran-4-yl)ethyl]-4-piperidinyl]-N-phenylbenzenesulfonamide IUPAC Name: benzenesulfonic acid; N-[1-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]piperidin-4-yl]-N-phenylbenzenesulfonamide Traditional Name: besylic acid; N-[1-(2-chroman-4-ylethyl)-4-piperidyl]-N-phenyl-benzenesulfonamide Formula: C34H38N2O6S2 MolecularWeight: 634.80532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)CCC4CCOC5=CC=CC=C45.C1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

C1CN(CCC1N(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)CCC4CCOC5=CC=CC=C45.C1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C28H32N2O3S.C6H6O3S/c31-34(32,26-11-5-2-6-12-26)30(24-9-3-1-4-10-24)25-16-20-29(21-17-25)19-15-23-18-22-33-28-14-8-7-13-27(23)28;7-10(8,9)6-4-2-1-3-5-6/h1-14,23,25H,15-22H2;1-5H,(H,7,8,9)