tert-butyl N-[(2S)-1-[(2S)-2-ethynylpyrrolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[(2S)-2-ethynylpyrrolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(2S)-2-ethynylpyrrolidine-1-carbonyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-[(2S)-2-ethynyl-1-pyrrolidinyl]-3-methyl-1-oxobutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[(2S)-2-ethynylpyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(2S)-2-ethynylpyrrolidine-1-carbonyl]-2-methyl-propyl]carbamic acid tert-butyl ester Formula: C16H26N2O3 MolecularWeight: 294.38924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCC1C#C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC[C@H]1C#C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C16H26N2O3/c1-7-12-9-8-10-18(12)14(19)13(11(2)3)17-15(20)21-16(4,5)6/h1,11-13H,8-10H2,2-6H3,(H,17,20)/t12-,13+/m1/s1