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

Systemtic Name: propan-2-yl (3R)-3-(2-chlorophenyl)-3-[(4-ethoxy-5-methoxy-2-nitro-phenyl)carbonylamino]propanoate Openeye Name: isopropyl (3R)-3-(2-chlorophenyl)-3-[(4-ethoxy-5-methoxy-2-nitro-benzoyl)amino]propanoate CAS Name: (3R)-3-(2-chlorophenyl)-3-[[(4-ethoxy-5-methoxy-2-nitrophenyl)-oxomethyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (3R)-3-(2-chlorophenyl)-3-[(4-ethoxy-5-methoxy-2-nitrobenzoyl)amino]propanoate Traditional Name: (3R)-3-(2-chlorophenyl)-3-[(4-ethoxy-5-methoxy-2-nitro-benzoyl)amino]propionic acid isopropyl ester Formula: C22H25ClN2O7 MolecularWeight: 464.8961

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC(CC(=O)OC(C)C)C2=CC=CC=C2Cl)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)N[C@H](CC(=O)OC(C)C)C2=CC=CC=C2Cl)OC

InChI

InChI=1S/C22H25ClN2O7/c1-5-31-20-12-18(25(28)29)15(10-19(20)30-4)22(27)24-17(11-21(26)32-13(2)3)14-8-6-7-9-16(14)23/h6-10,12-13,17H,5,11H2,1-4H3,(H,24,27)/t17-/m1/s1