tert-butyl 1-[2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 1-[2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]ethanoyl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl 1-[2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]acetyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]-1-oxoethyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]acetyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2-(naphthionylamino)acetyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCCN1C(=O)CNS(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C1CCCN1C(=O)CNS(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C

InChI

InChI=1S/C23H31N3O5S/c1-23(2,3)31-22(28)19-12-8-14-26(19)21(27)15-24-32(29,30)20-13-7-9-16-17(20)10-6-11-18(16)25(4)5/h6-7,9-11,13,19,24H,8,12,14-15H2,1-5H3