disodium 9,9-bis(3-azanyl-3-oxidanylidene-propyl)fluorene-2,7-disulfonate

Systemtic Name: disodium 9,9-bis(3-azanyl-3-oxidanylidene-propyl)fluorene-2,7-disulfonate Openeye Name: disodium 9,9-bis(3-amino-3-oxo-propyl)fluorene-2,7-disulfonate CAS Name: disodium 9,9-bis(3-amino-3-oxopropyl)fluorene-2,7-disulfonate IUPAC Name: disodium 9,9-bis(3-amino-3-oxopropyl)fluorene-2,7-disulfonate Traditional Name: disodium 9,9-bis(3-amino-3-keto-propyl)fluorene-2,7-disulfonate Formula: C19H18N2Na2O8S2 MolecularWeight: 512.46436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)[O-])C(C3=C2C=CC(=C3)S(=O)(=O)[O-])(CCC(=O)N)CCC(=O)N.[Na+].[Na+]

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)[O-])C(C3=C2C=CC(=C3)S(=O)(=O)[O-])(CCC(=O)N)CCC(=O)N.[Na+].[Na+]

InChI

InChI=1S/C19H20N2O8S2.2Na/c20-17(22)5-7-19(8-6-18(21)23)15-9-11(30(24,25)26)1-3-13(15)14-4-2-12(10-16(14)19)31(27,28)29;;/h1-4,9-10H,5-8H2,(H2,20,22)(H2,21,23)(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2