4-[4,5-bis(azanyl)-2-methoxy-phenoxy]butane-1-sulfonic acid

Systemtic Name: 4-[4,5-bis(azanyl)-2-methoxy-phenoxy]butane-1-sulfonic acid Openeye Name: 4-(4,5-diamino-2-methoxy-phenoxy)butane-1-sulfonic acid CAS Name: 4-(4,5-diamino-2-methoxyphenoxy)-1-butanesulfonic acid IUPAC Name: 4-(4,5-diamino-2-methoxyphenoxy)butane-1-sulfonic acid Traditional Name: 4-(4,5-diamino-2-methoxy-phenoxy)butane-1-sulfonic acid Formula: C11H18N2O5S MolecularWeight: 290.33602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)N)N)OCCCCS(=O)(=O)O

Isomeric SMILES

COC1=C(C=C(C(=C1)N)N)OCCCCS(=O)(=O)O

InChI

InChI=1S/C11H18N2O5S/c1-17-10-6-8(12)9(13)7-11(10)18-4-2-3-5-19(14,15)16/h6-7H,2-5,12-13H2,1H3,(H,14,15,16)