ethyl 7-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-oct-2-ynoate

Systemtic Name: ethyl 7-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-oct-2-ynoate Openeye Name: ethyl 5-(tert-butoxycarbonylamino)-4-hydroxy-7-methyl-oct-2-ynoate CAS Name: 4-hydroxy-7-methyl-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-octynoic acid ethyl ester IUPAC Name: ethyl 4-hydroxy-7-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]oct-2-ynoate Traditional Name: 5-(tert-butoxycarbonylamino)-4-hydroxy-7-methyl-oct-2-ynoic acid ethyl ester Formula: C16H27NO5 MolecularWeight: 313.38928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO5/c1-7-21-14(19)9-8-13(18)12(10-11(2)3)17-15(20)22-16(4,5)6/h11-13,18H,7,10H2,1-6H3,(H,17,20)