2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]ethanoic acid; piperidine

Systemtic Name: 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]ethanoic acid; piperidine Openeye Name: 2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]acetic acid; piperidine CAS Name: 2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]acetic acid; piperidine IUPAC Name: 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]acetic acid; piperidine Traditional Name: 2-(naphthionylamino)acetic acid; piperidine Formula: C19H27N3O4S MolecularWeight: 393.50038

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NCC(=O)O.C1CCNCC1

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NCC(=O)O.C1CCNCC1

InChI

InChI=1S/C14H16N2O4S.C5H11N/c1-16(2)12-7-3-6-11-10(12)5-4-8-13(11)21(19,20)15-9-14(17)18;1-2-4-6-5-3-1/h3-8,15H,9H2,1-2H3,(H,17,18);6H,1-5H2