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

Systemtic Name: 4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]butyl 4-methylbenzenesulfonate Openeye Name: 4-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]butyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 4-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]butyl ester IUPAC Name: 4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]butyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 4-(naphthionylamino)butyl ester Formula: C23H28N2O5S2 MolecularWeight: 476.60882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O5S2/c1-18-12-14-19(15-13-18)32(28,29)30-17-5-4-16-24-31(26,27)23-11-7-8-20-21(23)9-6-10-22(20)25(2)3/h6-15,24H,4-5,16-17H2,1-3H3