5-[(8-oxidanyl-3,6-disulfo-naphthalen-1-yl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(8-oxidanyl-3,6-disulfo-naphthalen-1-yl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(8-hydroxy-3,6-disulfo-1-naphthyl)amino]-5-oxo-pentanoic acid CAS Name: 5-[(8-hydroxy-3,6-disulfo-1-naphthalenyl)amino]-5-oxopentanoic acid IUPAC Name: 5-[(8-hydroxy-3,6-disulfonaphthalen-1-yl)amino]-5-oxopentanoic acid Traditional Name: 5-[(8-hydroxy-3,6-disulfo-1-naphthyl)amino]-5-keto-valeric acid Formula: C15H15NO10S2 MolecularWeight: 433.4103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)NC(=O)CCCC(=O)O)O)S(=O)(=O)O

Isomeric SMILES

C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)NC(=O)CCCC(=O)O)O)S(=O)(=O)O

InChI

InChI=1S/C15H15NO10S2/c17-12-7-10(28(24,25)26)5-8-4-9(27(21,22)23)6-11(15(8)12)16-13(18)2-1-3-14(19)20/h4-7,17H,1-3H2,(H,16,18)(H,19,20)(H,21,22,23)(H,24,25,26)