[4-[2-(2,2-dimethylpropoxycarbonylamino)-3-ethoxy-3-oxidanylidene-propyl]-2-ethanoyl-phenyl] pentanoate

Systemtic Name: [4-[2-(2,2-dimethylpropoxycarbonylamino)-3-ethoxy-3-oxidanylidene-propyl]-2-ethanoyl-phenyl] pentanoate Openeye Name: [2-acetyl-4-[2-(2,2-dimethylpropoxycarbonylamino)-3-ethoxy-3-oxo-propyl]phenyl] pentanoate CAS Name: pentanoic acid [2-acetyl-4-[2-[[2,2-dimethylpropoxy(oxo)methyl]amino]-3-ethoxy-3-oxopropyl]phenyl] ester IUPAC Name: [2-acetyl-4-[2-(2,2-dimethylpropoxycarbonylamino)-3-ethoxy-3-oxopropyl]phenyl] pentanoate Traditional Name: valeric acid [2-acetyl-4-[3-ethoxy-3-keto-2-(neopentyloxycarbonylamino)propyl]phenyl] ester Formula: C24H35NO7 MolecularWeight: 449.5372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=C(C=C(C=C1)CC(C(=O)OCC)NC(=O)OCC(C)(C)C)C(=O)C

Isomeric SMILES

CCCCC(=O)OC1=C(C=C(C=C1)CC(C(=O)OCC)NC(=O)OCC(C)(C)C)C(=O)C

InChI

InChI=1S/C24H35NO7/c1-7-9-10-21(27)32-20-12-11-17(13-18(20)16(3)26)14-19(22(28)30-8-2)25-23(29)31-15-24(4,5)6/h11-13,19H,7-10,14-15H2,1-6H3,(H,25,29)