ethyl (2S)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoylamino]-3-phenyl-propanoate

Systemtic Name: ethyl (2S)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoylamino]-3-phenyl-propanoate Openeye Name: ethyl (2S)-2-[2-(tert-butoxycarbonylamino)prop-2-enoylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoprop-2-enyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-(tert-butoxycarbonylamino)acryloyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C(=C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C(=C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H26N2O5/c1-6-25-17(23)15(12-14-10-8-7-9-11-14)21-16(22)13(2)20-18(24)26-19(3,4)5/h7-11,15H,2,6,12H2,1,3-5H3,(H,20,24)(H,21,22)/t15-/m0/s1