[(2S)-1-[(2-methoxy-5-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(3-methyl-4-propan-2-yl-phenoxy)ethanoate

Systemtic Name: [(2S)-1-[(2-methoxy-5-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(3-methyl-4-propan-2-yl-phenoxy)ethanoate Openeye Name: [(1S)-2-(2-methoxy-5-nitro-anilino)-1-methyl-2-oxo-ethyl] 2-(4-isopropyl-3-methyl-phenoxy)acetate CAS Name: 2-(3-methyl-4-propan-2-ylphenoxy)acetic acid [(2S)-1-(2-methoxy-5-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methoxy-5-nitroanilino)-1-oxopropan-2-yl] 2-(3-methyl-4-propan-2-ylphenoxy)acetate Traditional Name: 2-(4-isopropyl-3-methyl-phenoxy)acetic acid [(1S)-2-keto-2-(2-methoxy-5-nitro-anilino)-1-methyl-ethyl] ester Formula: C22H26N2O7 MolecularWeight: 430.45104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)OC(C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)O[C@@H](C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)C(C)C

InChI

InChI=1S/C22H26N2O7/c1-13(2)18-8-7-17(10-14(18)3)30-12-21(25)31-15(4)22(26)23-19-11-16(24(27)28)6-9-20(19)29-5/h6-11,13,15H,12H2,1-5H3,(H,23,26)/t15-/m0/s1