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

Systemtic Name: [(3S,4S)-4-methyl-5-oxidanylidene-hept-1-en-3-yl] N-(1-phenylethyl)carbamate Openeye Name: [(1S,2S)-2-methyl-3-oxo-1-vinyl-pentyl] N-(1-phenylethyl)carbamate CAS Name: N-(1-phenylethyl)carbamic acid [(3S,4S)-4-methyl-5-oxohept-1-en-3-yl] ester IUPAC Name: [(3S,4S)-4-methyl-5-oxohept-1-en-3-yl] N-(1-phenylethyl)carbamate Traditional Name: N-(1-phenylethyl)carbamic acid [(1S)-1-[(1S)-2-keto-1-methyl-butyl]allyl] ester Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO3/c1-5-15(19)12(3)16(6-2)21-17(20)18-13(4)14-10-8-7-9-11-14/h6-13,16H,2,5H2,1,3-4H3,(H,18,20)/t12-,13?,16+/m1/s1