N-[4-(azepan-1-ylsulfonyl)phenyl]quinoline-8-sulfonamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]quinoline-8-sulfonamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]quinoline-8-sulfonamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-8-quinolinesulfonamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]quinoline-8-sulfonamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]quinoline-8-sulfonamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H23N3O4S2/c25-29(26,20-9-5-7-17-8-6-14-22-21(17)20)23-18-10-12-19(13-11-18)30(27,28)24-15-3-1-2-4-16-24/h5-14,23H,1-4,15-16H2