4-methylbenzenesulfonic acid; 1-oxidanyl-1-[[(E)-(6-oxidanylidene-5-prop-2-enyl-cyclohexa-2,4-dien-1-ylidene)methyl]amino]guanidine

Systemtic Name: 4-methylbenzenesulfonic acid; 1-oxidanyl-1-[[(E)-(6-oxidanylidene-5-prop-2-enyl-cyclohexa-2,4-dien-1-ylidene)methyl]amino]guanidine Openeye Name: 1-[[(E)-(5-allyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1-hydroxy-guanidine; 4-methylbenzenesulfonic acid CAS Name: 1-hydroxy-1-[[(E)-(6-oxo-5-prop-2-enyl-1-cyclohexa-2,4-dienylidene)methyl]amino]guanidine; 4-methylbenzenesulfonic acid IUPAC Name: 1-hydroxy-1-[[(E)-(6-oxo-5-prop-2-enylcyclohexa-2,4-dien-1-ylidene)methyl]amino]guanidine; 4-methylbenzenesulfonic acid Traditional Name: 1-[[(E)-(5-allyl-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1-hydroxy-guanidine; tosylic acid Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C=CCC1=CC=CC(=CNN(C(=N)N)O)C1=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C=CCC1=CC=C/C(=C\NN(C(=N)N)O)/C1=O

InChI

InChI=1S/C11H14N4O2.C7H8O3S/c1-2-4-8-5-3-6-9(10(8)16)7-14-15(17)11(12)13;1-6-2-4-7(5-3-6)11(8,9)10/h2-3,5-7,14,17H,1,4H2,(H3,12,13);2-5H,1H3,(H,8,9,10)/b9-7+;