tert-butyl N-[(2S)-1-(1-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-yl)but-3-en-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-(1-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-yl)but-3-en-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(1-hydroxy-4-oxo-cyclohexa-2,5-dien-1-yl)methyl]allyl]carbamate CAS Name: N-[(2S)-1-(1-hydroxy-4-oxo-1-cyclohexa-2,5-dienyl)but-3-en-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-(1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)but-3-en-2-yl]carbamate Traditional Name: N-[(1S)-1-[(1-hydroxy-4-keto-cyclohexa-2,5-dien-1-yl)methyl]allyl]carbamic acid tert-butyl ester Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1(C=CC(=O)C=C1)O)C=C

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1(C=CC(=O)C=C1)O)C=C

InChI

InChI=1S/C15H21NO4/c1-5-11(16-13(18)20-14(2,3)4)10-15(19)8-6-12(17)7-9-15/h5-9,11,19H,1,10H2,2-4H3,(H,16,18)/t11-/m1/s1