N-butyl-1,3-bis(oxidanylidene)-N-pentyl-benzo[de]isoquinoline-5-sulfonamide

Systemtic Name: N-butyl-1,3-bis(oxidanylidene)-N-pentyl-benzo[de]isoquinoline-5-sulfonamide Openeye Name: N-butyl-1,3-dioxo-N-pentyl-benzo[de]isoquinoline-5-sulfonamide CAS Name: N-butyl-1,3-dioxo-N-pentyl-5-benzo[de]isoquinolinesulfonamide IUPAC Name: N-butyl-1,3-dioxo-N-pentylbenzo[de]isoquinoline-5-sulfonamide Traditional Name: N-amyl-N-butyl-1,3-diketo-benzo[de]isoquinoline-5-sulfonamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCC)S(=O)(=O)C1=CC2=C3C(=C1)C=CC=C3C(=O)NC2=O

Isomeric SMILES

CCCCCN(CCCC)S(=O)(=O)C1=CC2=C3C(=C1)C=CC=C3C(=O)NC2=O

InChI

InChI=1S/C21H26N2O4S/c1-3-5-7-12-23(11-6-4-2)28(26,27)16-13-15-9-8-10-17-19(15)18(14-16)21(25)22-20(17)24/h8-10,13-14H,3-7,11-12H2,1-2H3,(H,22,24,25)