2,6-bis(azanyl)-2-[5-(dimethylamino)naphthalen-1-yl]sulfonyl-hexanoic acid

Systemtic Name: 2,6-bis(azanyl)-2-[5-(dimethylamino)naphthalen-1-yl]sulfonyl-hexanoic acid Openeye Name: 2,6-diamino-2-[[5-(dimethylamino)-1-naphthyl]sulfonyl]hexanoic acid CAS Name: 2,6-diamino-2-[[5-(dimethylamino)-1-naphthalenyl]sulfonyl]hexanoic acid IUPAC Name: 2,6-diamino-2-[5-(dimethylamino)naphthalen-1-yl]sulfonylhexanoic acid Traditional Name: 2,6-diamino-2-naphthionyl-hexanoic acid Formula: C18H25N3O4S MolecularWeight: 379.4738

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)C(CCCCN)(C(=O)O)N

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)C(CCCCN)(C(=O)O)N

InChI

InChI=1S/C18H25N3O4S/c1-21(2)15-9-5-8-14-13(15)7-6-10-16(14)26(24,25)18(20,17(22)23)11-3-4-12-19/h5-10H,3-4,11-12,19-20H2,1-2H3,(H,22,23)