(phenylmethyl) N-[(4S,5S)-5-methyl-3-oxidanylidene-hept-1-en-4-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(4S,5S)-5-methyl-3-oxidanylidene-hept-1-en-4-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(1S)-1-methylpropyl]-2-oxo-but-3-enyl]carbamate CAS Name: N-[(4S,5S)-5-methyl-3-oxohept-1-en-4-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(4S,5S)-5-methyl-3-oxohept-1-en-4-yl]carbamate Traditional Name: N-[(1S)-2-keto-1-[(1S)-1-methylpropyl]but-3-enyl]carbamic acid benzyl ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)C=C)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)C=C)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H21NO3/c1-4-12(3)15(14(18)5-2)17-16(19)20-11-13-9-7-6-8-10-13/h5-10,12,15H,2,4,11H2,1,3H3,(H,17,19)/t12-,15-/m0/s1