[3-methoxy-2-methyl-1-oxidanyl-2-(perylen-3-ylmethylamino)propyl] methanesulfonate

Systemtic Name: [3-methoxy-2-methyl-1-oxidanyl-2-(perylen-3-ylmethylamino)propyl] methanesulfonate Openeye Name: [1-hydroxy-3-methoxy-2-methyl-2-(perylen-3-ylmethylamino)propyl] methanesulfonate CAS Name: methanesulfonic acid [1-hydroxy-3-methoxy-2-methyl-2-(3-perylenylmethylamino)propyl] ester IUPAC Name: [1-hydroxy-3-methoxy-2-methyl-2-(perylen-3-ylmethylamino)propyl] methanesulfonate Traditional Name: methanesulfonic acid [1-hydroxy-3-methoxy-2-methyl-2-(perylen-3-ylmethylamino)propyl] ester Formula: C27H27NO5S MolecularWeight: 477.57198

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)(C(O)OS(=O)(=O)C)NCC1=CC=C2C3=CC=CC4=C3C(=CC=C4)C5=C2C1=CC=C5

Isomeric SMILES

CC(COC)(C(O)OS(=O)(=O)C)NCC1=CC=C2C3=CC=CC4=C3C(=CC=C4)C5=C2C1=CC=C5

InChI

InChI=1S/C27H27NO5S/c1-27(16-32-2,26(29)33-34(3,30)31)28-15-18-13-14-23-21-11-5-8-17-7-4-10-20(24(17)21)22-12-6-9-19(18)25(22)23/h4-14,26,28-29H,15-16H2,1-3H3