[2-[[4-chloranyl-10-(2-hydroxyethyloxy)anthracen-9-yl]methylamino]-2-methyl-3-oxidanyl-propyl] methanesulfonate

Systemtic Name: [2-[[4-chloranyl-10-(2-hydroxyethyloxy)anthracen-9-yl]methylamino]-2-methyl-3-oxidanyl-propyl] methanesulfonate Openeye Name: [2-[[4-chloro-10-(2-hydroxyethoxy)-9-anthryl]methylamino]-3-hydroxy-2-methyl-propyl] methanesulfonate CAS Name: methanesulfonic acid [2-[[4-chloro-10-(2-hydroxyethoxy)-9-anthracenyl]methylamino]-3-hydroxy-2-methylpropyl] ester IUPAC Name: [2-[[4-chloro-10-(2-hydroxyethoxy)anthracen-9-yl]methylamino]-3-hydroxy-2-methylpropyl] methanesulfonate Traditional Name: methanesulfonic acid [2-[[4-chloro-10-(2-hydroxyethoxy)-9-anthryl]methylamino]-3-hydroxy-2-methyl-propyl] ester Formula: C22H26ClNO6S MolecularWeight: 467.96294

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(COS(=O)(=O)C)NCC1=C2C=CC=C(C2=C(C3=CC=CC=C31)OCCO)Cl

Isomeric SMILES

CC(CO)(COS(=O)(=O)C)NCC1=C2C=CC=C(C2=C(C3=CC=CC=C31)OCCO)Cl

InChI

InChI=1S/C22H26ClNO6S/c1-22(13-26,14-30-31(2,27)28)24-12-18-15-6-3-4-7-17(15)21(29-11-10-25)20-16(18)8-5-9-19(20)23/h3-9,24-26H,10-14H2,1-2H3