(3S)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)-5-(3-phenylpropoxy)pentanoic acid

Systemtic Name: (3S)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)-5-(3-phenylpropoxy)pentanoic acid Openeye Name: (3S)-3-(benzyloxycarbonylamino)-4-oxo-5-(3-phenylpropoxy)pentanoic acid CAS Name: (3S)-4-oxo-3-(phenylmethoxycarbonylamino)-5-(3-phenylpropoxy)pentanoic acid IUPAC Name: (3S)-4-oxo-3-(phenylmethoxycarbonylamino)-5-(3-phenylpropoxy)pentanoic acid Traditional Name: (3S)-3-(benzyloxycarbonylamino)-4-keto-5-(3-phenylpropoxy)valeric acid Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOCC(=O)C(CC(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CCCOCC(=O)[C@H](CC(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H25NO6/c24-20(16-28-13-7-12-17-8-3-1-4-9-17)19(14-21(25)26)23-22(27)29-15-18-10-5-2-6-11-18/h1-6,8-11,19H,7,12-16H2,(H,23,27)(H,25,26)/t19-/m0/s1