(phenylmethyl) N-[(2S)-4-methyl-1-oxidanyl-1-(2-oxidanylidenecyclohexyl)pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-4-methyl-1-oxidanyl-1-(2-oxidanylidenecyclohexyl)pentan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[hydroxy-(2-oxocyclohexyl)methyl]-3-methyl-butyl]carbamate CAS Name: N-[(2S)-1-hydroxy-4-methyl-1-(2-oxocyclohexyl)pentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-hydroxy-4-methyl-1-(2-oxocyclohexyl)pentan-2-yl]carbamate Traditional Name: N-[(1S)-1-[hydroxy-(2-ketocyclohexyl)methyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C20H29NO4 MolecularWeight: 347.44856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C1CCCCC1=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](C(C1CCCCC1=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H29NO4/c1-14(2)12-17(19(23)16-10-6-7-11-18(16)22)21-20(24)25-13-15-8-4-3-5-9-15/h3-5,8-9,14,16-17,19,23H,6-7,10-13H2,1-2H3,(H,21,24)/t16?,17-,19?/m0/s1