3-phenyl-2-[[2-(phenylcarbonyl)-1,2-diazinan-1-yl]carbonyloxy]propanoic acid

Systemtic Name: 3-phenyl-2-[[2-(phenylcarbonyl)-1,2-diazinan-1-yl]carbonyloxy]propanoic acid Openeye Name: 2-(2-benzoylhexahydropyridazine-1-carbonyl)oxy-3-phenyl-propanoic acid CAS Name: 2-[(2-benzoyl-1-diazinanyl)-oxomethoxy]-3-phenylpropanoic acid IUPAC Name: 2-(2-benzoyldiazinane-1-carbonyl)oxy-3-phenylpropanoic acid Traditional Name: 2-(2-benzoylhexahydropyridazine-1-carbonyl)oxy-3-phenyl-propionic acid Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(N(C1)C(=O)C2=CC=CC=C2)C(=O)OC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CCN(N(C1)C(=O)C2=CC=CC=C2)C(=O)OC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H22N2O5/c24-19(17-11-5-2-6-12-17)22-13-7-8-14-23(22)21(27)28-18(20(25)26)15-16-9-3-1-4-10-16/h1-6,9-12,18H,7-8,13-15H2,(H,25,26)