[1,6-bis(bromanyl)naphthalen-2-yl] 2-methyl-3-nitro-benzenesulfonate

Systemtic Name: [1,6-bis(bromanyl)naphthalen-2-yl] 2-methyl-3-nitro-benzenesulfonate Openeye Name: (1,6-dibromo-2-naphthyl) 2-methyl-3-nitro-benzenesulfonate CAS Name: 2-methyl-3-nitrobenzenesulfonic acid (1,6-dibromo-2-naphthalenyl) ester IUPAC Name: (1,6-dibromonaphthalen-2-yl) 2-methyl-3-nitrobenzenesulfonate Traditional Name: 2-methyl-3-nitro-benzenesulfonic acid (1,6-dibromo-2-naphthyl) ester Formula: C17H11Br2NO5S MolecularWeight: 501.14594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)OC2=C(C3=C(C=C2)C=C(C=C3)Br)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)OC2=C(C3=C(C=C2)C=C(C=C3)Br)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H11Br2NO5S/c1-10-14(20(21)22)3-2-4-16(10)26(23,24)25-15-8-5-11-9-12(18)6-7-13(11)17(15)19/h2-9H,1H3