propan-2-yl 3-[(2-iodanyl-3-methyl-phenyl)carbonylamino]-3-(2-nitrophenyl)propanoate

Systemtic Name: propan-2-yl 3-[(2-iodanyl-3-methyl-phenyl)carbonylamino]-3-(2-nitrophenyl)propanoate Openeye Name: isopropyl 3-[(2-iodo-3-methyl-benzoyl)amino]-3-(2-nitrophenyl)propanoate CAS Name: 3-[[(2-iodo-3-methylphenyl)-oxomethyl]amino]-3-(2-nitrophenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[(2-iodo-3-methylbenzoyl)amino]-3-(2-nitrophenyl)propanoate Traditional Name: 3-[(2-iodo-3-methyl-benzoyl)amino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C20H21IN2O5 MolecularWeight: 496.29561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1I)C(=O)NC(CC(=O)OC(C)C)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1I)C(=O)NC(CC(=O)OC(C)C)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C20H21IN2O5/c1-12(2)28-18(24)11-16(14-8-4-5-10-17(14)23(26)27)22-20(25)15-9-6-7-13(3)19(15)21/h4-10,12,16H,11H2,1-3H3,(H,22,25)