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

Systemtic Name: 2-[(2-cyclohexylcarbonyl-1,2-diazinan-1-yl)carbonyloxy]-3-phenyl-propanoic acid Openeye Name: 2-[2-(cyclohexanecarbonyl)hexahydropyridazine-1-carbonyl]oxy-3-phenyl-propanoic acid CAS Name: 2-[[2-[cyclohexyl(oxo)methyl]-1-diazinanyl]-oxomethoxy]-3-phenylpropanoic acid IUPAC Name: 2-[2-(cyclohexanecarbonyl)diazinane-1-carbonyl]oxy-3-phenylpropanoic acid Traditional Name: 2-[2-(cyclohexanecarbonyl)hexahydropyridazine-1-carbonyl]oxy-3-phenyl-propionic acid Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCCCN2C(=O)OC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CCC(CC1)C(=O)N2CCCCN2C(=O)OC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H28N2O5/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/h1,3-4,9-10,17-18H,2,5-8,11-15H2,(H,25,26)