tert-butyl (2S)-4-[(2S)-4-methyl-1-oxidanyl-pentan-2-yl]-3-oxidanylidene-2-prop-2-enyl-1,4-diazepane-1-carboxylate

Systemtic Name: tert-butyl (2S)-4-[(2S)-4-methyl-1-oxidanyl-pentan-2-yl]-3-oxidanylidene-2-prop-2-enyl-1,4-diazepane-1-carboxylate Openeye Name: tert-butyl (2S)-2-allyl-4-[(1S)-1-(hydroxymethyl)-3-methyl-butyl]-3-oxo-1,4-diazepane-1-carboxylate CAS Name: (2S)-4-[(2S)-1-hydroxy-4-methylpentan-2-yl]-3-oxo-2-prop-2-enyl-1,4-diazepane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-4-[(2S)-1-hydroxy-4-methylpentan-2-yl]-3-oxo-2-prop-2-enyl-1,4-diazepane-1-carboxylate Traditional Name: (2S)-2-allyl-3-keto-4-[(1S)-3-methyl-1-methylol-butyl]-1,4-diazepane-1-carboxylic acid tert-butyl ester Formula: C19H34N2O4 MolecularWeight: 354.48426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CO)N1CCCN(C(C1=O)CC=C)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C[C@@H](CO)N1CCCN([C@H](C1=O)CC=C)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H34N2O4/c1-7-9-16-17(23)20(15(13-22)12-14(2)3)10-8-11-21(16)18(24)25-19(4,5)6/h7,14-16,22H,1,8-13H2,2-6H3/t15-,16-/m0/s1