[2-[2-[(7-acetamido-9H-fluoren-2-yl)oxy]ethylamino]-1-oxidanyl-ethyl]-(2H-1,3-benzoxazol-3-ylsulfonyl)-dimethyl-azanium

Systemtic Name: [2-[2-[(7-acetamido-9H-fluoren-2-yl)oxy]ethylamino]-1-oxidanyl-ethyl]-(2H-1,3-benzoxazol-3-ylsulfonyl)-dimethyl-azanium Openeye Name: [2-[2-[(7-acetamido-9H-fluoren-2-yl)oxy]ethylamino]-1-hydroxy-ethyl]-(2H-1,3-benzoxazol-3-ylsulfonyl)-dimethyl-ammonium CAS Name: [2-[2-[(7-acetamido-9H-fluoren-2-yl)oxy]ethylamino]-1-hydroxyethyl]-(2H-1,3-benzoxazol-3-ylsulfonyl)-dimethylammonium IUPAC Name: [2-[2-[(7-acetamido-9H-fluoren-2-yl)oxy]ethylamino]-1-hydroxyethyl]-(2H-1,3-benzoxazol-3-ylsulfonyl)-dimethylazanium Traditional Name: [2-[2-[(7-acetamido-9H-fluoren-2-yl)oxy]ethylamino]-1-hydroxy-ethyl]-(2H-1,3-benzoxazol-3-ylsulfonyl)-dimethyl-ammonium Formula: C28H33N4O6S+ MolecularWeight: 553.64982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)OCCNCC([N+](C)(C)S(=O)(=O)N4COC5=CC=CC=C54)O

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)OCCNCC([N+](C)(C)S(=O)(=O)N4COC5=CC=CC=C54)O

InChI

InChI=1S/C28H32N4O6S/c1-19(33)30-22-8-10-24-20(15-22)14-21-16-23(9-11-25(21)24)37-13-12-29-17-28(34)32(2,3)39(35,36)31-18-38-27-7-5-4-6-26(27)31/h4-11,15-16,28-29,34H,12-14,17-18H2,1-3H3/p+1