2-[[(3S)-1-oxidanyl-2-oxidanylidene-5-phenyl-pentan-3-yl]carbamoyl]-4-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: 2-[[(3S)-1-oxidanyl-2-oxidanylidene-5-phenyl-pentan-3-yl]carbamoyl]-4-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: 4-(benzyloxycarbonylamino)-2-[[(1S)-3-hydroxy-2-oxo-1-phenethyl-propyl]carbamoyl]butanoic acid CAS Name: 2-[[[(3S)-1-hydroxy-2-oxo-5-phenylpentan-3-yl]amino]-oxomethyl]-4-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: 2-[[(3S)-1-hydroxy-2-oxo-5-phenylpentan-3-yl]carbamoyl]-4-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: 4-(benzyloxycarbonylamino)-2-[[(1S)-3-hydroxy-2-keto-1-phenethyl-propyl]carbamoyl]butyric acid Formula: C24H28N2O7 MolecularWeight: 456.48832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)CO)NC(=O)C(CCNC(=O)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C24H28N2O7/c27-15-21(28)20(12-11-17-7-3-1-4-8-17)26-22(29)19(23(30)31)13-14-25-24(32)33-16-18-9-5-2-6-10-18/h1-10,19-20,27H,11-16H2,(H,25,32)(H,26,29)(H,30,31)/t19?,20-/m0/s1