(phenylmethyl) (2S)-1-[(2S)-2-[(5-hexyl-2-oxidanylidene-oxolan-3-yl)amino]propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) (2S)-1-[(2S)-2-[(5-hexyl-2-oxidanylidene-oxolan-3-yl)amino]propanoyl]pyrrolidine-2-carboxylate Openeye Name: benzyl (2S)-1-[(2S)-2-[(5-hexyl-2-oxo-tetrahydrofuran-3-yl)amino]propanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2S)-2-[(5-hexyl-2-oxo-3-oxolanyl)amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-1-[(2S)-2-[(5-hexyl-2-oxooxolan-3-yl)amino]propanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2S)-2-[(5-hexyl-2-keto-tetrahydrofuran-3-yl)amino]propanoyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C25H36N2O5 MolecularWeight: 444.56374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC(C(=O)O1)NC(C)C(=O)N2CCCC2C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCC1CC(C(=O)O1)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H36N2O5/c1-3-4-5-9-13-20-16-21(24(29)32-20)26-18(2)23(28)27-15-10-14-22(27)25(30)31-17-19-11-7-6-8-12-19/h6-8,11-12,18,20-22,26H,3-5,9-10,13-17H2,1-2H3/t18-,20?,21?,22-/m0/s1