[2-(chrysen-3-ylmethylamino)-2-methyl-1,3-bis(oxidanyl)propyl] methanesulfonate

Systemtic Name: [2-(chrysen-3-ylmethylamino)-2-methyl-1,3-bis(oxidanyl)propyl] methanesulfonate Openeye Name: [2-(chrysen-3-ylmethylamino)-1,3-dihydroxy-2-methyl-propyl] methanesulfonate CAS Name: methanesulfonic acid [2-(3-chrysenylmethylamino)-1,3-dihydroxy-2-methylpropyl] ester IUPAC Name: [2-(chrysen-3-ylmethylamino)-1,3-dihydroxy-2-methylpropyl] methanesulfonate Traditional Name: methanesulfonic acid [2-(chrysen-3-ylmethylamino)-1,3-dihydroxy-2-methyl-propyl] ester Formula: C24H25NO5S MolecularWeight: 439.524

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(C(O)OS(=O)(=O)C)NCC1=CC2=C(C=C1)C=CC3=C2C=CC4=CC=CC=C43

Isomeric SMILES

CC(CO)(C(O)OS(=O)(=O)C)NCC1=CC2=C(C=C1)C=CC3=C2C=CC4=CC=CC=C43

InChI

InChI=1S/C24H25NO5S/c1-24(15-26,23(27)30-31(2,28)29)25-14-16-7-8-18-10-11-20-19-6-4-3-5-17(19)9-12-21(20)22(18)13-16/h3-13,23,25-27H,14-15H2,1-2H3