N-butyl-N-methyl-3-(4-methylpiperidin-1-yl)-1,4-bis(oxidanylidene)naphthalene-2-sulfonamide

Systemtic Name: N-butyl-N-methyl-3-(4-methylpiperidin-1-yl)-1,4-bis(oxidanylidene)naphthalene-2-sulfonamide Openeye Name: N-butyl-N-methyl-3-(4-methyl-1-piperidyl)-1,4-dioxo-naphthalene-2-sulfonamide CAS Name: N-butyl-N-methyl-3-(4-methyl-1-piperidinyl)-1,4-dioxo-2-naphthalenesulfonamide IUPAC Name: N-butyl-N-methyl-3-(4-methylpiperidin-1-yl)-1,4-dioxonaphthalene-2-sulfonamide Traditional Name: N-butyl-1,4-diketo-N-methyl-3-(4-methylpiperidino)naphthalene-2-sulfonamide Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=C(C(=O)C2=CC=CC=C2C1=O)N3CCC(CC3)C

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=C(C(=O)C2=CC=CC=C2C1=O)N3CCC(CC3)C

InChI

InChI=1S/C21H28N2O4S/c1-4-5-12-22(3)28(26,27)21-18(23-13-10-15(2)11-14-23)19(24)16-8-6-7-9-17(16)20(21)25/h6-9,15H,4-5,10-14H2,1-3H3