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

Systemtic Name: 4-[(2E)-2-(4-oxidanylidene-3-propan-2-yl-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]naphthalene-1-sulfonic acid Openeye Name: 4-[(2E)-2-(3-isopropyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)hydrazino]naphthalene-1-sulfonic acid CAS Name: 4-[(2E)-2-(4-oxo-3-propan-2-yl-1-cyclohexa-2,5-dienylidene)hydrazinyl]-1-naphthalenesulfonic acid IUPAC Name: 4-[(2E)-2-(4-oxo-3-propan-2-ylcyclohexa-2,5-dien-1-ylidene)hydrazinyl]naphthalene-1-sulfonic acid Traditional Name: 4-[(N'E)-N'-(3-isopropyl-4-keto-cyclohexa-2,5-dien-1-ylidene)hydrazino]naphthalene-1-sulfonic acid Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NNC2=CC=C(C3=CC=CC=C32)S(=O)(=O)O)C=CC1=O

Isomeric SMILES

CC(C)C1=C/C(=N/NC2=CC=C(C3=CC=CC=C32)S(=O)(=O)O)/C=CC1=O

InChI

InChI=1S/C19H18N2O4S/c1-12(2)16-11-13(7-9-18(16)22)20-21-17-8-10-19(26(23,24)25)15-6-4-3-5-14(15)17/h3-12,21H,1-2H3,(H,23,24,25)/b20-13+