4-[(2E)-2-(4-oxidanylidene-3-propan-2-yl-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzenesulfonic acid

Systemtic Name: 4-[(2E)-2-(4-oxidanylidene-3-propan-2-yl-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzenesulfonic acid Openeye Name: 4-[(2E)-2-(3-isopropyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)hydrazino]benzenesulfonic acid CAS Name: 4-[(2E)-2-(4-oxo-3-propan-2-yl-1-cyclohexa-2,5-dienylidene)hydrazinyl]benzenesulfonic acid IUPAC Name: 4-[(2E)-2-(4-oxo-3-propan-2-ylcyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzenesulfonic acid Traditional Name: 4-[(N'E)-N'-(3-isopropyl-4-keto-cyclohexa-2,5-dien-1-ylidene)hydrazino]besylic acid Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NNC2=CC=C(C=C2)S(=O)(=O)O)C=CC1=O

Isomeric SMILES

CC(C)C1=C/C(=N/NC2=CC=C(C=C2)S(=O)(=O)O)/C=CC1=O

InChI

InChI=1S/C15H16N2O4S/c1-10(2)14-9-12(5-8-15(14)18)17-16-11-3-6-13(7-4-11)22(19,20)21/h3-10,16H,1-2H3,(H,19,20,21)/b17-12+