N-cyclopentyl-2-methoxy-5-[[(3-nitrophenyl)carbonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N-cyclopentyl-2-methoxy-5-[[(3-nitrophenyl)carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N-cyclopentyl-2-methoxy-5-[[(3-nitrobenzoyl)amino]carbamoyl]benzenesulfonamide CAS Name: N-cyclopentyl-2-methoxy-5-[[[(3-nitrophenyl)-oxomethyl]hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: N-cyclopentyl-2-methoxy-5-[[(3-nitrobenzoyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N-cyclopentyl-2-methoxy-5-[[(3-nitrobenzoyl)amino]carbamoyl]benzenesulfonamide Formula: C20H22N4O7S MolecularWeight: 462.47628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)NC3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)NC3CCCC3

InChI

InChI=1S/C20H22N4O7S/c1-31-17-10-9-14(12-18(17)32(29,30)23-15-6-2-3-7-15)20(26)22-21-19(25)13-5-4-8-16(11-13)24(27)28/h4-5,8-12,15,23H,2-3,6-7H2,1H3,(H,21,25)(H,22,26)