ethyl 4-[ethoxycarbonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-methyl-hept-2-ynoate

Systemtic Name: ethyl 4-[ethoxycarbonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-methyl-hept-2-ynoate Openeye Name: ethyl 4-[tert-butoxycarbonyl(ethoxycarbonyl)amino]-6-methyl-hept-2-ynoate CAS Name: 4-[ethoxycarbonyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-methyl-2-heptynoic acid ethyl ester IUPAC Name: ethyl 4-[ethoxycarbonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-methylhept-2-ynoate Traditional Name: 4-[tert-butoxycarbonyl(carbethoxy)amino]-6-methyl-hept-2-ynoic acid ethyl ester Formula: C18H29NO6 MolecularWeight: 355.42596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C#CC(CC(C)C)N(C(=O)OCC)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C#CC(CC(C)C)N(C(=O)OCC)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H29NO6/c1-8-23-15(20)11-10-14(12-13(3)4)19(16(21)24-9-2)17(22)25-18(5,6)7/h13-14H,8-9,12H2,1-7H3