3,4-dihydro-1H-isoquinolin-2-yl-(6-methylsulfonyliminocyclohexa-2,4-dien-1-ylidene)methanolate

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-(6-methylsulfonyliminocyclohexa-2,4-dien-1-ylidene)methanolate Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-(6-methylsulfonyliminocyclohexa-2,4-dien-1-ylidene)methanolate CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-(6-methylsulfonylimino-1-cyclohexa-2,4-dienylidene)methanolate IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-(6-methylsulfonyliminocyclohexa-2,4-dien-1-ylidene)methanolate Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(6-mesyliminocyclohexa-2,4-dien-1-ylidene)methanolate Formula: C17H17N2O3S- MolecularWeight: 329.39348

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N=C1C=CC=CC1=C(N2CCC3=CC=CC=C3C2)[O-]

Isomeric SMILES

CS(=O)(=O)N=C1C=CC=CC1=C(N2CCC3=CC=CC=C3C2)[O-]

InChI

InChI=1S/C17H18N2O3S/c1-23(21,22)18-16-9-5-4-8-15(16)17(20)19-11-10-13-6-2-3-7-14(13)12-19/h2-9,20H,10-12H2,1H3/p-1