(phenylmethyl) (2S)-2-[[(2R)-2-azanyl-2-cyclopentyl-ethanoyl]amino]-4-methyl-pentanoate

Systemtic Name: (phenylmethyl) (2S)-2-[[(2R)-2-azanyl-2-cyclopentyl-ethanoyl]amino]-4-methyl-pentanoate Openeye Name: benzyl (2S)-2-[[(2R)-2-amino-2-cyclopentyl-acetyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(2R)-2-amino-2-cyclopentyl-1-oxoethyl]amino]-4-methylpentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[(2R)-2-amino-2-cyclopentylacetyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[(2R)-2-amino-2-cyclopentyl-acetyl]amino]-4-methyl-valeric acid benzyl ester Formula: C20H30N2O3 MolecularWeight: 346.4638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(=O)C(C2CCCC2)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)[C@@H](C2CCCC2)N

InChI

InChI=1S/C20H30N2O3/c1-14(2)12-17(20(24)25-13-15-8-4-3-5-9-15)22-19(23)18(21)16-10-6-7-11-16/h3-5,8-9,14,16-18H,6-7,10-13,21H2,1-2H3,(H,22,23)/t17-,18+/m0/s1