methyl sulfate; 1,2,3,3-tetramethylbenzo[e]indol-3-ium

Systemtic Name: methyl sulfate; 1,2,3,3-tetramethylbenzo[e]indol-3-ium Openeye Name: methyl sulfate; 1,2,3,3-tetramethylbenzo[e]indol-3-ium CAS Name: methyl sulfate; 1,2,3,3-tetramethylbenzo[e]indol-3-ium IUPAC Name: methyl sulfate; 1,2,3,3-tetramethylbenzo[e]indol-3-ium Traditional Name: methyl sulfate; 1,2,3,3-tetramethylbenz[e]indol-3-ium Formula: C17H21NO4S MolecularWeight: 335.41794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](C2=C1C3=CC=CC=C3C=C2)(C)C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CC1=C([N+](C2=C1C3=CC=CC=C3C=C2)(C)C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C16H18N.CH4O4S/c1-11-12(2)17(3,4)15-10-9-13-7-5-6-8-14(13)16(11)15;1-5-6(2,3)4/h5-10H,1-4H3;1H3,(H,2,3,4)/q+1;/p-1