(phenylmethyl) (2R)-2-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-4-methyl-pentanoate

Systemtic Name: (phenylmethyl) (2R)-2-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-4-methyl-pentanoate Openeye Name: benzyl (2R)-2-[2-(cyclohexylamino)-2-oxo-ethyl]-4-methyl-pentanoate CAS Name: (2R)-2-[2-(cyclohexylamino)-2-oxoethyl]-4-methylpentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2R)-2-[2-(cyclohexylamino)-2-oxoethyl]-4-methylpentanoate Traditional Name: (2R)-2-[2-(cyclohexylamino)-2-keto-ethyl]-4-methyl-valeric acid benzyl ester Formula: C21H31NO3 MolecularWeight: 345.47574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)NC1CCCCC1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@H](CC(=O)NC1CCCCC1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H31NO3/c1-16(2)13-18(14-20(23)22-19-11-7-4-8-12-19)21(24)25-15-17-9-5-3-6-10-17/h3,5-6,9-10,16,18-19H,4,7-8,11-15H2,1-2H3,(H,22,23)/t18-/m1/s1