7,8-diazido-5,6-bis(oxidanylidene)naphthalene-1-sulfonic acid; 4-methylbenzene-1,3-diol

Systemtic Name: 7,8-diazido-5,6-bis(oxidanylidene)naphthalene-1-sulfonic acid; 4-methylbenzene-1,3-diol Openeye Name: 7,8-diazido-5,6-dioxo-naphthalene-1-sulfonic acid; 4-methylbenzene-1,3-diol CAS Name: 7,8-diazido-5,6-dioxo-1-naphthalenesulfonic acid; 4-methylbenzene-1,3-diol IUPAC Name: 7,8-diazido-5,6-dioxonaphthalene-1-sulfonic acid; 4-methylbenzene-1,3-diol Traditional Name: 7,8-diazido-5,6-diketo-naphthalene-1-sulfonic acid; 4-methylresorcinol Formula: C17H12N6O7S MolecularWeight: 444.37818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)O)O.C1=CC2=C(C(=C1)S(=O)(=O)O)C(=C(C(=O)C2=O)N=[N+]=[N-])N=[N+]=[N-]

Isomeric SMILES

CC1=C(C=C(C=C1)O)O.C1=CC2=C(C(=C1)S(=O)(=O)O)C(=C(C(=O)C2=O)N=[N+]=[N-])N=[N+]=[N-]

InChI

InChI=1S/C10H4N6O5S.C7H8O2/c11-15-13-7-6-4(2-1-3-5(6)22(19,20)21)9(17)10(18)8(7)14-16-12;1-5-2-3-6(8)4-7(5)9/h1-3H,(H,19,20,21);2-4,8-9H,1H3