(2R)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-sulfo-propanoic acid

Systemtic Name: (2R)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-sulfo-propanoic acid Openeye Name: (2R)-2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]-3-sulfo-propanoic acid CAS Name: (2R)-2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]-3-sulfopropanoic acid IUPAC Name: (2R)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-sulfopropanoic acid Traditional Name: (2R)-2-(naphthionylamino)-3-sulfo-propionic acid Formula: C15H18N2O7S2 MolecularWeight: 402.44262

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CS(=O)(=O)O)C(=O)O

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)N[C@@H](CS(=O)(=O)O)C(=O)O

InChI

InChI=1S/C15H18N2O7S2/c1-17(2)13-7-3-6-11-10(13)5-4-8-14(11)26(23,24)16-12(15(18)19)9-25(20,21)22/h3-8,12,16H,9H2,1-2H3,(H,18,19)(H,20,21,22)/t12-/m0/s1