ethyl (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-ynoate

Systemtic Name: ethyl (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-ynoate Openeye Name: ethyl (3S)-3-(tert-butoxycarbonylamino)pent-4-ynoate CAS Name: (3S)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-pentynoic acid ethyl ester IUPAC Name: ethyl (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-ynoate Traditional Name: (3S)-3-(tert-butoxycarbonylamino)pent-4-ynoic acid ethyl ester Formula: C12H19NO4 MolecularWeight: 241.28356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C#C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C[C@@H](C#C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C12H19NO4/c1-6-9(8-10(14)16-7-2)13-11(15)17-12(3,4)5/h1,9H,7-8H2,2-5H3,(H,13,15)/t9-/m1/s1