2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-N-phenethyl-pentanamide

Systemtic Name: 2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-N-phenethyl-pentanamide Openeye Name: 2-[(4-chloro-3-nitro-phenyl)sulfonylamino]-N-phenethyl-pentanamide CAS Name: 2-[(4-chloro-3-nitrophenyl)sulfonylamino]-N-phenethylpentanamide IUPAC Name: 2-[(4-chloro-3-nitrophenyl)sulfonylamino]-N-phenethylpentanamide Traditional Name: 2-[(4-chloro-3-nitro-phenyl)sulfonylamino]-N-phenethyl-valeramide Formula: C19H22ClN3O5S MolecularWeight: 439.91308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NCCC1=CC=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCC(C(=O)NCCC1=CC=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H22ClN3O5S/c1-2-6-17(19(24)21-12-11-14-7-4-3-5-8-14)22-29(27,28)15-9-10-16(20)18(13-15)23(25)26/h3-5,7-10,13,17,22H,2,6,11-12H2,1H3,(H,21,24)