methyl (2S)-6-(phenylmethoxycarbonylamino)-2-(prop-2-enoylamino)hexanoate

Systemtic Name: methyl (2S)-6-(phenylmethoxycarbonylamino)-2-(prop-2-enoylamino)hexanoate Openeye Name: methyl (2S)-6-(benzyloxycarbonylamino)-2-(prop-2-enoylamino)hexanoate CAS Name: (2S)-2-(1-oxoprop-2-enylamino)-6-(phenylmethoxycarbonylamino)hexanoic acid methyl ester IUPAC Name: methyl (2S)-6-(phenylmethoxycarbonylamino)-2-(prop-2-enoylamino)hexanoate Traditional Name: (2S)-2-acrylamido-6-(benzyloxycarbonylamino)hexanoic acid methyl ester Formula: C18H24N2O5 MolecularWeight: 348.39356

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCCNC(=O)OCC1=CC=CC=C1)NC(=O)C=C

Isomeric SMILES

COC(=O)[C@H](CCCCNC(=O)OCC1=CC=CC=C1)NC(=O)C=C

InChI

InChI=1S/C18H24N2O5/c1-3-16(21)20-15(17(22)24-2)11-7-8-12-19-18(23)25-13-14-9-5-4-6-10-14/h3-6,9-10,15H,1,7-8,11-13H2,2H3,(H,19,23)(H,20,21)/t15-/m0/s1