ethyl 3-[[(1R)-1-(4-methoxyphenyl)-3-oxidanylidene-3-propan-2-yloxy-propyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[(1R)-1-(4-methoxyphenyl)-3-oxidanylidene-3-propan-2-yloxy-propyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[(1R)-3-isopropoxy-1-(4-methoxyphenyl)-3-oxo-propyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[(1R)-1-(4-methoxyphenyl)-3-oxo-3-propan-2-yloxypropyl]amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[(1R)-1-(4-methoxyphenyl)-3-oxo-3-propan-2-yloxypropyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[(1R)-3-isopropoxy-3-keto-1-(4-methoxyphenyl)propyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C23H26N2O8 MolecularWeight: 458.46114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O8/c1-5-32-23(28)17-10-16(11-18(12-17)25(29)30)22(27)24-20(13-21(26)33-14(2)3)15-6-8-19(31-4)9-7-15/h6-12,14,20H,5,13H2,1-4H3,(H,24,27)/t20-/m1/s1