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

Systemtic Name: methyl sulfate; 1,1,2,3-tetramethyl-2,3-dihydrobenzo[e]indol-3-ium Openeye Name: methyl sulfate; 1,1,2,3-tetramethyl-2,3-dihydrobenzo[e]indol-3-ium CAS Name: methyl sulfate; 1,1,2,3-tetramethyl-2,3-dihydrobenzo[e]indol-3-ium IUPAC Name: methyl sulfate; 1,1,2,3-tetramethyl-2,3-dihydrobenzo[e]indol-3-ium Traditional Name: methyl sulfate; 1,1,2,3-tetramethyl-2,3-dihydrobenz[e]indol-3-ium Formula: C17H23NO4S MolecularWeight: 337.43382

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=C([NH+]1C)C=CC3=CC=CC=C32)(C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CC1C(C2=C([NH+]1C)C=CC3=CC=CC=C32)(C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C16H19N.CH4O4S/c1-11-16(2,3)15-13-8-6-5-7-12(13)9-10-14(15)17(11)4;1-5-6(2,3)4/h5-11H,1-4H3;1H3,(H,2,3,4)