naphthalen-2-yl 2-methyl-5-nitro-benzenesulfonate

Systemtic Name: naphthalen-2-yl 2-methyl-5-nitro-benzenesulfonate Openeye Name: 2-naphthyl 2-methyl-5-nitro-benzenesulfonate CAS Name: 2-methyl-5-nitrobenzenesulfonic acid 2-naphthalenyl ester IUPAC Name: naphthalen-2-yl 2-methyl-5-nitrobenzenesulfonate Traditional Name: 2-methyl-5-nitro-benzenesulfonic acid 2-naphthyl ester Formula: C17H13NO5S MolecularWeight: 343.35382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C17H13NO5S/c1-12-6-8-15(18(19)20)11-17(12)24(21,22)23-16-9-7-13-4-2-3-5-14(13)10-16/h2-11H,1H3