5-nitro-2-[(2E)-2-[2-oxidanylidene-6-(2-sulfooxyethylsulfonyl)naphthalen-1-ylidene]hydrazinyl]benzenesulfonic acid

Systemtic Name: 5-nitro-2-[(2E)-2-[2-oxidanylidene-6-(2-sulfooxyethylsulfonyl)naphthalen-1-ylidene]hydrazinyl]benzenesulfonic acid Openeye Name: 5-nitro-2-[(2E)-2-[2-oxo-6-(2-sulfooxyethylsulfonyl)-1-naphthylidene]hydrazino]benzenesulfonic acid CAS Name: 5-nitro-2-[(2E)-2-[2-oxo-6-(2-sulfooxyethylsulfonyl)-1-naphthalenylidene]hydrazinyl]benzenesulfonic acid IUPAC Name: 5-nitro-2-[(2E)-2-[2-oxo-6-(2-sulfooxyethylsulfonyl)naphthalen-1-ylidene]hydrazinyl]benzenesulfonic acid Traditional Name: 2-[(N'E)-N'-[2-keto-6-(2-sulfoxyethylsulfonyl)-1-naphthylidene]hydrazino]-5-nitro-besylic acid Formula: C18H15N3O12S3 MolecularWeight: 561.5196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)O)NN=C2C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)O)N/N=C/2\C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O

InChI

InChI=1S/C18H15N3O12S3/c22-16-6-1-11-9-13(34(25,26)8-7-33-36(30,31)32)3-4-14(11)18(16)20-19-15-5-2-12(21(23)24)10-17(15)35(27,28)29/h1-6,9-10,19H,7-8H2,(H,27,28,29)(H,30,31,32)/b20-18+