[4-[4-methyl-7-methylsulfonyloxy-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2H-chromen-3-yl]phenyl] methanesulfonate

Systemtic Name: [4-[4-methyl-7-methylsulfonyloxy-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2H-chromen-3-yl]phenyl] methanesulfonate Openeye Name: [4-[4-methyl-7-methylsulfonyloxy-2-[4-[2-(1-piperidyl)ethoxy]phenyl]-2H-chromen-3-yl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[4-methyl-7-methylsulfonyloxy-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-2H-1-benzopyran-3-yl]phenyl] ester IUPAC Name: [4-[4-methyl-7-methylsulfonyloxy-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2H-chromen-3-yl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[4-methyl-7-methylsulfonyloxy-2-[4-(2-piperidinoethoxy)phenyl]-2H-chromen-3-yl]phenyl] ester Formula: C31H35NO8S2 MolecularWeight: 613.7415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(OC2=C1C=CC(=C2)OS(=O)(=O)C)C3=CC=C(C=C3)OCCN4CCCCC4)C5=CC=C(C=C5)OS(=O)(=O)C

Isomeric SMILES

CC1=C(C(OC2=C1C=CC(=C2)OS(=O)(=O)C)C3=CC=C(C=C3)OCCN4CCCCC4)C5=CC=C(C=C5)OS(=O)(=O)C

InChI

InChI=1S/C31H35NO8S2/c1-22-28-16-15-27(40-42(3,35)36)21-29(28)38-31(30(22)23-7-13-26(14-8-23)39-41(2,33)34)24-9-11-25(12-10-24)37-20-19-32-17-5-4-6-18-32/h7-16,21,31H,4-6,17-20H2,1-3H3