methyl (2S)-5-[2-(3,4-dimethoxyphenyl)ethylamino]-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: methyl (2S)-5-[2-(3,4-dimethoxyphenyl)ethylamino]-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: methyl (2S)-2-(benzyloxycarbonylamino)-5-[2-(3,4-dimethoxyphenyl)ethylamino]-5-oxo-pentanoate CAS Name: (2S)-5-[2-(3,4-dimethoxyphenyl)ethylamino]-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid methyl ester IUPAC Name: methyl (2S)-5-[2-(3,4-dimethoxyphenyl)ethylamino]-5-oxo-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-5-(homoveratrylamino)-5-keto-valeric acid methyl ester Formula: C24H30N2O7 MolecularWeight: 458.5042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCC(C(=O)OC)NC(=O)OCC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CC[C@@H](C(=O)OC)NC(=O)OCC2=CC=CC=C2)OC

InChI

InChI=1S/C24H30N2O7/c1-30-20-11-9-17(15-21(20)31-2)13-14-25-22(27)12-10-19(23(28)32-3)26-24(29)33-16-18-7-5-4-6-8-18/h4-9,11,15,19H,10,12-14,16H2,1-3H3,(H,25,27)(H,26,29)/t19-/m0/s1