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

Systemtic Name: (phenylmethyl) (2S)-1-[(2S)-2-[(5-decyl-2-oxidanylidene-oxolan-3-yl)amino]propanoyl]pyrrolidine-2-carboxylate Openeye Name: benzyl (2S)-1-[(2S)-2-[(5-decyl-2-oxo-tetrahydrofuran-3-yl)amino]propanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2S)-2-[(5-decyl-2-oxo-3-oxolanyl)amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-1-[(2S)-2-[(5-decyl-2-oxooxolan-3-yl)amino]propanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2S)-2-[(5-decyl-2-keto-tetrahydrofuran-3-yl)amino]propanoyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C29H44N2O5 MolecularWeight: 500.67006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1CC(C(=O)O1)NC(C)C(=O)N2CCCC2C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCC1CC(C(=O)O1)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C29H44N2O5/c1-3-4-5-6-7-8-9-13-17-24-20-25(28(33)36-24)30-22(2)27(32)31-19-14-18-26(31)29(34)35-21-23-15-11-10-12-16-23/h10-12,15-16,22,24-26,30H,3-9,13-14,17-21H2,1-2H3/t22-,24?,25?,26-/m0/s1