(phenylmethyl) (4R)-4-benzamido-5-oxidanylidene-5-(3-oxidanylpropylamino)pentanoate

Systemtic Name: (phenylmethyl) (4R)-4-benzamido-5-oxidanylidene-5-(3-oxidanylpropylamino)pentanoate Openeye Name: benzyl (4R)-4-benzamido-5-(3-hydroxypropylamino)-5-oxo-pentanoate CAS Name: (4R)-4-benzamido-5-(3-hydroxypropylamino)-5-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (4R)-4-benzamido-5-(3-hydroxypropylamino)-5-oxopentanoate Traditional Name: (4R)-4-benzamido-5-(3-hydroxypropylamino)-5-keto-valeric acid benzyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCC(C(=O)NCCCO)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CC[C@H](C(=O)NCCCO)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H26N2O5/c25-15-7-14-23-22(28)19(24-21(27)18-10-5-2-6-11-18)12-13-20(26)29-16-17-8-3-1-4-9-17/h1-6,8-11,19,25H,7,12-16H2,(H,23,28)(H,24,27)/t19-/m1/s1