[6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-(3-oxidanylidenepiperazin-1-yl)methanolate

Systemtic Name: [6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-(3-oxidanylidenepiperazin-1-yl)methanolate Openeye Name: [6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-(3-oxopiperazin-1-yl)methanolate CAS Name: [6-(4-chlorophenyl)sulfonylimino-1-cyclohexa-2,4-dienylidene]-(3-oxo-1-piperazinyl)methanolate IUPAC Name: [6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-(3-oxopiperazin-1-yl)methanolate Traditional Name: [6-(4-chlorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-(3-ketopiperazino)methanolate Formula: C17H15ClN3O4S- MolecularWeight: 392.8367

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C(=C2C=CC=CC2=NS(=O)(=O)C3=CC=C(C=C3)Cl)[O-]

Isomeric SMILES

C1CN(CC(=O)N1)C(=C2C=CC=CC2=NS(=O)(=O)C3=CC=C(C=C3)Cl)[O-]

InChI

InChI=1S/C17H16ClN3O4S/c18-12-5-7-13(8-6-12)26(24,25)20-15-4-2-1-3-14(15)17(23)21-10-9-19-16(22)11-21/h1-8,23H,9-11H2,(H,19,22)/p-1