ethyl (2S)-2-[[(1S)-1-phenylethyl]-prop-2-enoyl-amino]-2-(phenylmethoxycarbonylamino)ethanoate

Systemtic Name: ethyl (2S)-2-[[(1S)-1-phenylethyl]-prop-2-enoyl-amino]-2-(phenylmethoxycarbonylamino)ethanoate Openeye Name: ethyl (2S)-2-(benzyloxycarbonylamino)-2-[[(1S)-1-phenylethyl]-prop-2-enoyl-amino]acetate CAS Name: (2S)-2-[1-oxoprop-2-enyl-[(1S)-1-phenylethyl]amino]-2-(phenylmethoxycarbonylamino)acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[(1S)-1-phenylethyl]-prop-2-enoylamino]-2-(phenylmethoxycarbonylamino)acetate Traditional Name: (2S)-2-[acryloyl-[(1S)-1-phenylethyl]amino]-2-(benzyloxycarbonylamino)acetic acid ethyl ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(NC(=O)OCC1=CC=CC=C1)N(C(C)C2=CC=CC=C2)C(=O)C=C

Isomeric SMILES

CCOC(=O)[C@@H](NC(=O)OCC1=CC=CC=C1)N([C@@H](C)C2=CC=CC=C2)C(=O)C=C

InChI

InChI=1S/C23H26N2O5/c1-4-20(26)25(17(3)19-14-10-7-11-15-19)21(22(27)29-5-2)24-23(28)30-16-18-12-8-6-9-13-18/h4,6-15,17,21H,1,5,16H2,2-3H3,(H,24,28)/t17-,21-/m0/s1