(phenylmethyl) N-[(Z,3S)-2-methyl-4-oxidanyl-6-oxidanylidene-hept-4-en-3-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(Z,3S)-2-methyl-4-oxidanyl-6-oxidanylidene-hept-4-en-3-yl]carbamate Openeye Name: benzyl N-[(Z,1S)-2-hydroxy-1-isopropyl-4-oxo-pent-2-enyl]carbamate CAS Name: N-[(Z,3S)-4-hydroxy-2-methyl-6-oxohept-4-en-3-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(Z,3S)-4-hydroxy-2-methyl-6-oxohept-4-en-3-yl]carbamate Traditional Name: N-[(Z,1S)-2-hydroxy-1-isopropyl-4-keto-pent-2-enyl]carbamic acid benzyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO4/c1-11(2)15(14(19)9-12(3)18)17-16(20)21-10-13-7-5-4-6-8-13/h4-9,11,15,19H,10H2,1-3H3,(H,17,20)/b14-9-/t15-/m0/s1