N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-(2-methoxy-5-morpholinosulfonyl-phenyl)-3-(2-nitroanilino)propanamide CAS Name: N-[2-methoxy-5-(4-morpholinylsulfonyl)phenyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-3-(2-nitroanilino)propanamide Traditional Name: N-(2-methoxy-5-morpholinosulfonyl-phenyl)-3-(2-nitroanilino)propionamide Formula: C20H24N4O7S MolecularWeight: 464.49216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O7S/c1-30-19-7-6-15(32(28,29)23-10-12-31-13-11-23)14-17(19)22-20(25)8-9-21-16-4-2-3-5-18(16)24(26)27/h2-7,14,21H,8-13H2,1H3,(H,22,25)