5-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]pentyl 4-methylbenzenesulfonate

Systemtic Name: 5-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]pentyl 4-methylbenzenesulfonate Openeye Name: 5-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]pentyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 5-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]pentyl ester IUPAC Name: 5-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]pentyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 5-(naphthionylamino)pentyl ester Formula: C24H30N2O5S2 MolecularWeight: 490.6354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCNS(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCNS(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C

InChI

InChI=1S/C24H30N2O5S2/c1-19-13-15-20(16-14-19)33(29,30)31-18-6-4-5-17-25-32(27,28)24-12-8-9-21-22(24)10-7-11-23(21)26(2)3/h7-16,25H,4-6,17-18H2,1-3H3