ethyl 2-[[(2-methylpropan-2-yl)oxycarbonyl-oct-1-ynyl-amino]methyl]pent-4-enoate

Systemtic Name: ethyl 2-[[(2-methylpropan-2-yl)oxycarbonyl-oct-1-ynyl-amino]methyl]pent-4-enoate Openeye Name: ethyl 2-[[tert-butoxycarbonyl(oct-1-ynyl)amino]methyl]pent-4-enoate CAS Name: 2-[[[(2-methylpropan-2-yl)oxy-oxomethyl]-oct-1-ynylamino]methyl]-4-pentenoic acid ethyl ester IUPAC Name: ethyl 2-[[(2-methylpropan-2-yl)oxycarbonyl-oct-1-ynylamino]methyl]pent-4-enoate Traditional Name: 2-[[tert-butoxycarbonyl(oct-1-ynyl)amino]methyl]pent-4-enoic acid ethyl ester Formula: C21H35NO4 MolecularWeight: 365.5069

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CN(CC(CC=C)C(=O)OCC)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCC#CN(CC(CC=C)C(=O)OCC)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H35NO4/c1-7-10-11-12-13-14-16-22(20(24)26-21(4,5)6)17-18(15-8-2)19(23)25-9-3/h8,18H,2,7,9-13,15,17H2,1,3-6H3