N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(dimethylamino)naphthalene-1-sulfonamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(dimethylamino)naphthalene-1-sulfonamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(dimethylamino)naphthalene-1-sulfonamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(dimethylamino)-1-naphthalenesulfonamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(dimethylamino)naphthalene-1-sulfonamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(dimethylamino)naphthalene-1-sulfonamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H22N2O4S/c1-23(2)18-8-3-7-17-16(18)6-4-9-21(17)28(24,25)22-15-10-11-19-20(14-15)27-13-5-12-26-19/h3-4,6-11,14,22H,5,12-13H2,1-2H3