5-azanyl-4-ethyl-7-[2-(hydroxymethyl)phenoxy]-2-phenyl-6-propyl-quinoline-3-sulfonamide

Systemtic Name: 5-azanyl-4-ethyl-7-[2-(hydroxymethyl)phenoxy]-2-phenyl-6-propyl-quinoline-3-sulfonamide Openeye Name: 5-amino-4-ethyl-7-[2-(hydroxymethyl)phenoxy]-2-phenyl-6-propyl-quinoline-3-sulfonamide CAS Name: 5-amino-4-ethyl-7-[2-(hydroxymethyl)phenoxy]-2-phenyl-6-propyl-3-quinolinesulfonamide IUPAC Name: 5-amino-4-ethyl-7-[2-(hydroxymethyl)phenoxy]-2-phenyl-6-propylquinoline-3-sulfonamide Traditional Name: 5-amino-4-ethyl-7-(2-methylolphenoxy)-2-phenyl-6-propyl-quinoline-3-sulfonamide Formula: C27H29N3O4S MolecularWeight: 491.60186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C2C(=C1N)C(=C(C(=N2)C3=CC=CC=C3)S(=O)(=O)N)CC)OC4=CC=CC=C4CO

Isomeric SMILES

CCCC1=C(C=C2C(=C1N)C(=C(C(=N2)C3=CC=CC=C3)S(=O)(=O)N)CC)OC4=CC=CC=C4CO

InChI

InChI=1S/C27H29N3O4S/c1-3-10-20-23(34-22-14-9-8-13-18(22)16-31)15-21-24(25(20)28)19(4-2)27(35(29,32)33)26(30-21)17-11-6-5-7-12-17/h5-9,11-15,31H,3-4,10,16,28H2,1-2H3,(H2,29,32,33)