(2R)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]butanedioic acid

Systemtic Name: (2R)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]butanedioic acid Openeye Name: (2R)-2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]butanedioic acid CAS Name: (2R)-2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]butanedioic acid IUPAC Name: (2R)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]butanedioic acid Traditional Name: (2R)-2-(naphthionylamino)succinic acid Formula: C16H18N2O6S MolecularWeight: 374.359088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)N[14C@H]([14CH2][14C](=O)O)[14C](=O)O

InChI

InChI=1S/C16H18N2O6S/c1-18(2)13-7-3-6-11-10(13)5-4-8-14(11)25(23,24)17-12(16(21)22)9-15(19)20/h3-8,12,17H,9H2,1-2H3,(H,19,20)(H,21,22)/t12-/m1/s1/i9+2,12+2,15+2,16+2