4-oxidanylidene-2,3-bis(phenylcarbonyloxy)-4-(propan-2-ylamino)butanoate

Systemtic Name: 4-oxidanylidene-2,3-bis(phenylcarbonyloxy)-4-(propan-2-ylamino)butanoate Openeye Name: 2,3-dibenzoyloxy-4-(isopropylamino)-4-oxo-butanoate CAS Name: 2,3-dibenzoyloxy-4-oxo-4-(propan-2-ylamino)butanoate IUPAC Name: 2,3-dibenzoyloxy-4-oxo-4-(propan-2-ylamino)butanoate Traditional Name: 2,3-dibenzoyloxy-4-(isopropylamino)-4-keto-butyrate Formula: C21H20NO7- MolecularWeight: 398.386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C(C(=O)[O-])OC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=O)C(C(C(=O)[O-])OC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H21NO7/c1-13(2)22-18(23)16(28-20(26)14-9-5-3-6-10-14)17(19(24)25)29-21(27)15-11-7-4-8-12-15/h3-13,16-17H,1-2H3,(H,22,23)(H,24,25)/p-1