[(2S)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-4-(4-pentylphenyl)butanoate

Systemtic Name: [(2S)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-4-(4-pentylphenyl)butanoate Openeye Name: [(1S)-2-(methoxycarbonylamino)-1-methyl-2-oxo-ethyl] 4-oxo-4-(4-pentylphenyl)butanoate CAS Name: 4-oxo-4-(4-pentylphenyl)butanoic acid [(2S)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] 4-oxo-4-(4-pentylphenyl)butanoate Traditional Name: 4-(4-amylphenyl)-4-keto-butyric acid [(1S)-2-(carbomethoxyamino)-2-keto-1-methyl-ethyl] ester Formula: C20H27NO6 MolecularWeight: 377.43148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)CCC(=O)OC(C)C(=O)NC(=O)OC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)CCC(=O)O[C@@H](C)C(=O)NC(=O)OC

InChI

InChI=1S/C20H27NO6/c1-4-5-6-7-15-8-10-16(11-9-15)17(22)12-13-18(23)27-14(2)19(24)21-20(25)26-3/h8-11,14H,4-7,12-13H2,1-3H3,(H,21,24,25)/t14-/m0/s1