4-oxidanylidene-2,3-bis(phenylcarbonyloxy)-4-[(2R)-1-phenylmethoxy-3-(propan-2-ylamino)propan-2-yl]oxy-butanoic acid

Systemtic Name: 4-oxidanylidene-2,3-bis(phenylcarbonyloxy)-4-[(2R)-1-phenylmethoxy-3-(propan-2-ylamino)propan-2-yl]oxy-butanoic acid Openeye Name: 2,3-dibenzoyloxy-4-[(1R)-1-(benzyloxymethyl)-2-(isopropylamino)ethoxy]-4-oxo-butanoic acid CAS Name: 2,3-dibenzoyloxy-4-oxo-4-[(2R)-1-phenylmethoxy-3-(propan-2-ylamino)propan-2-yl]oxybutanoic acid IUPAC Name: 2,3-dibenzoyloxy-4-oxo-4-[(2R)-1-phenylmethoxy-3-(propan-2-ylamino)propan-2-yl]oxybutanoic acid Traditional Name: 4-[(1R)-1-(benzoxymethyl)-2-(isopropylamino)ethoxy]-2,3-dibenzoyloxy-4-keto-butyric acid Formula: C31H33NO9 MolecularWeight: 563.59502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COCC1=CC=CC=C1)OC(=O)C(C(C(=O)O)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)NC[C@H](COCC1=CC=CC=C1)OC(=O)C(C(C(=O)O)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C31H33NO9/c1-21(2)32-18-25(20-38-19-22-12-6-3-7-13-22)39-31(37)27(41-30(36)24-16-10-5-11-17-24)26(28(33)34)40-29(35)23-14-8-4-9-15-23/h3-17,21,25-27,32H,18-20H2,1-2H3,(H,33,34)/t25-,26?,27?/m1/s1