methyl (2S)-2-[phenylmethoxycarbonyl(prop-2-ynyl)amino]but-3-enoate

Systemtic Name: methyl (2S)-2-[phenylmethoxycarbonyl(prop-2-ynyl)amino]but-3-enoate Openeye Name: methyl (2S)-2-[benzyloxycarbonyl(prop-2-ynyl)amino]but-3-enoate CAS Name: (2S)-2-[phenylmethoxycarbonyl(prop-2-ynyl)amino]-3-butenoic acid methyl ester IUPAC Name: methyl (2S)-2-[phenylmethoxycarbonyl(prop-2-ynyl)amino]but-3-enoate Traditional Name: (2S)-2-[carbobenzoxy(propargyl)amino]but-3-enoic acid methyl ester Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C=C)N(CC#C)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

COC(=O)[C@H](C=C)N(CC#C)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H17NO4/c1-4-11-17(14(5-2)15(18)20-3)16(19)21-12-13-9-7-6-8-10-13/h1,5-10,14H,2,11-12H2,3H3/t14-/m0/s1