4,5-bis[4-(prop-2-enoylamino)butoxy]benzene-1,3-disulfonic acid

Systemtic Name: 4,5-bis[4-(prop-2-enoylamino)butoxy]benzene-1,3-disulfonic acid Openeye Name: 4,5-bis[4-(prop-2-enoylamino)butoxy]benzene-1,3-disulfonic acid CAS Name: 4,5-bis[4-(1-oxoprop-2-enylamino)butoxy]benzene-1,3-disulfonic acid IUPAC Name: 4,5-bis[4-(prop-2-enoylamino)butoxy]benzene-1,3-disulfonic acid Traditional Name: 4,5-bis(4-acrylamidobutoxy)benzene-1,3-disulfonic acid Formula: C20H28N2O10S2 MolecularWeight: 520.57372

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NCCCCOC1=CC(=CC(=C1OCCCCNC(=O)C=C)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C=CC(=O)NCCCCOC1=CC(=CC(=C1OCCCCNC(=O)C=C)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C20H28N2O10S2/c1-3-18(23)21-9-5-7-11-31-16-13-15(33(25,26)27)14-17(34(28,29)30)20(16)32-12-8-6-10-22-19(24)4-2/h3-4,13-14H,1-2,5-12H2,(H,21,23)(H,22,24)(H,25,26,27)(H,28,29,30)