5-azanyl-2-(3-ethenylsulfonylphenyl)-1,3-bis(oxidanylidene)benzo[e]isoindole-4,7-disulfonate

Systemtic Name: 5-azanyl-2-(3-ethenylsulfonylphenyl)-1,3-bis(oxidanylidene)benzo[e]isoindole-4,7-disulfonate Openeye Name: 5-amino-1,3-dioxo-2-(3-vinylsulfonylphenyl)benzo[e]isoindole-4,7-disulfonate CAS Name: 5-amino-2-(3-ethenylsulfonylphenyl)-1,3-dioxobenzo[e]isoindole-4,7-disulfonate IUPAC Name: 5-amino-2-(3-ethenylsulfonylphenyl)-1,3-dioxobenzo[e]isoindole-4,7-disulfonate Traditional Name: 5-amino-1,3-diketo-2-(3-vinylsulfonylphenyl)benz[e]isoindole-4,7-disulfonate Formula: C20H12N2O10S3-2 MolecularWeight: 536.51168

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Descriptors Computed from Structure

Canonical SMILES:

C=CS(=O)(=O)C1=CC=CC(=C1)N2C(=O)C3=C(C2=O)C(=C(C4=C3C=CC(=C4)S(=O)(=O)[O-])N)S(=O)(=O)[O-]

Isomeric SMILES

C=CS(=O)(=O)C1=CC=CC(=C1)N2C(=O)C3=C(C2=O)C(=C(C4=C3C=CC(=C4)S(=O)(=O)[O-])N)S(=O)(=O)[O-]

InChI

InChI=1S/C20H14N2O10S3/c1-2-33(25,26)11-5-3-4-10(8-11)22-19(23)15-13-7-6-12(34(27,28)29)9-14(13)17(21)18(35(30,31)32)16(15)20(22)24/h2-9H,1,21H2,(H,27,28,29)(H,30,31,32)/p-2