methyl 4-[[(2S)-3-(4-hydroxyphenyl)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[(2S)-3-(4-hydroxyphenyl)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[[(1S)-2-benzyloxy-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]amino]-4-oxo-butanoate CAS Name: 4-[[(2S)-3-(4-hydroxyphenyl)-1-oxo-1-phenylmethoxypropan-2-yl]amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[[(2S)-3-(4-hydroxyphenyl)-1-oxo-1-phenylmethoxypropan-2-yl]amino]-4-oxobutanoate Traditional Name: 4-[[(1S)-2-benzoxy-1-(4-hydroxybenzyl)-2-keto-ethyl]amino]-4-keto-butyric acid methyl ester Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)NC(CC1=CC=C(C=C1)O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H23NO6/c1-27-20(25)12-11-19(24)22-18(13-15-7-9-17(23)10-8-15)21(26)28-14-16-5-3-2-4-6-16/h2-10,18,23H,11-14H2,1H3,(H,22,24)/t18-/m0/s1