4-(3,3-diethoxypropylamino)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: 4-(3,3-diethoxypropylamino)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-4-(3,3-diethoxypropylamino)-4-oxo-butanoic acid CAS Name: 4-(3,3-diethoxypropylamino)-4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: 4-(3,3-diethoxypropylamino)-4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: 3-(benzyloxycarbonylamino)-4-(3,3-diethoxypropylamino)-4-keto-butyric acid Formula: C19H28N2O7 MolecularWeight: 396.43482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CCNC(=O)C(CC(=O)O)NC(=O)OCC1=CC=CC=C1)OCC

Isomeric SMILES

CCOC(CCNC(=O)C(CC(=O)O)NC(=O)OCC1=CC=CC=C1)OCC

InChI

InChI=1S/C19H28N2O7/c1-3-26-17(27-4-2)10-11-20-18(24)15(12-16(22)23)21-19(25)28-13-14-8-6-5-7-9-14/h5-9,15,17H,3-4,10-13H2,1-2H3,(H,20,24)(H,21,25)(H,22,23)