5-oxidanyl-4-(prop-2-enoylamino)naphthalene-1,7-disulfonic acid

Systemtic Name: 5-oxidanyl-4-(prop-2-enoylamino)naphthalene-1,7-disulfonic acid Openeye Name: 5-hydroxy-4-(prop-2-enoylamino)naphthalene-1,7-disulfonic acid CAS Name: 5-hydroxy-4-(1-oxoprop-2-enylamino)naphthalene-1,7-disulfonic acid IUPAC Name: 5-hydroxy-4-(prop-2-enoylamino)naphthalene-1,7-disulfonic acid Traditional Name: 4-acrylamido-5-hydroxy-naphthalene-1,7-disulfonic acid Formula: C13H11NO8S2 MolecularWeight: 373.35834

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NC1=C2C(=CC(=CC2=C(C=C1)S(=O)(=O)O)S(=O)(=O)O)O

Isomeric SMILES

C=CC(=O)NC1=C2C(=CC(=CC2=C(C=C1)S(=O)(=O)O)S(=O)(=O)O)O

InChI

InChI=1S/C13H11NO8S2/c1-2-12(16)14-9-3-4-11(24(20,21)22)8-5-7(23(17,18)19)6-10(15)13(8)9/h2-6,15H,1H2,(H,14,16)(H,17,18,19)(H,20,21,22)