propan-2-yl 3-[[4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]phenyl]carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-[[4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]phenyl]carbonylamino]propanoate Openeye Name: isopropyl 3-[[4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]benzoyl]amino]propanoate CAS Name: 3-[[[4-[(2-methoxy-5-nitrophenyl)sulfamoyl]phenyl]-oxomethyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[4-[(2-methoxy-5-nitrophenyl)sulfamoyl]benzoyl]amino]propanoate Traditional Name: 3-[[4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]benzoyl]amino]propionic acid isopropyl ester Formula: C20H23N3O8S MolecularWeight: 465.47692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCNC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)OC(=O)CCNC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C20H23N3O8S/c1-13(2)31-19(24)10-11-21-20(25)14-4-7-16(8-5-14)32(28,29)22-17-12-15(23(26)27)6-9-18(17)30-3/h4-9,12-13,22H,10-11H2,1-3H3,(H,21,25)