(2S)-2-[[(3R)-4-methoxy-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[[(3R)-4-methoxy-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoyl]amino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[(3R)-3-(benzyloxycarbonylamino)-4-methoxy-4-oxo-butanoyl]amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[(3R)-4-methoxy-1,4-dioxo-3-(phenylmethoxycarbonylamino)butyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[[(3R)-4-methoxy-4-oxo-3-(phenylmethoxycarbonylamino)butanoyl]amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[(3R)-3-(benzyloxycarbonylamino)-4-keto-4-methoxy-butanoyl]amino]-3-phenyl-propionic acid Formula: C22H24N2O7 MolecularWeight: 428.43516

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H](CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H24N2O7/c1-30-21(28)18(24-22(29)31-14-16-10-6-3-7-11-16)13-19(25)23-17(20(26)27)12-15-8-4-2-5-9-15/h2-11,17-18H,12-14H2,1H3,(H,23,25)(H,24,29)(H,26,27)/t17-,18+/m0/s1