(1S,2R)-2-[[6-(4-chloranyl-2-cyclohexyl-phenoxy)pyridin-3-yl]carbamoyl]cyclopropane-1-carboxylate

Systemtic Name: (1S,2R)-2-[[6-(4-chloranyl-2-cyclohexyl-phenoxy)pyridin-3-yl]carbamoyl]cyclopropane-1-carboxylate Openeye Name: (1S,2R)-2-[[6-(4-chloro-2-cyclohexyl-phenoxy)-3-pyridyl]carbamoyl]cyclopropanecarboxylate CAS Name: (1S,2R)-2-[[[6-(4-chloro-2-cyclohexylphenoxy)-3-pyridinyl]amino]-oxomethyl]-1-cyclopropanecarboxylate IUPAC Name: (1S,2R)-2-[[6-(4-chloro-2-cyclohexylphenoxy)pyridin-3-yl]carbamoyl]cyclopropane-1-carboxylate Traditional Name: (1S,2R)-2-[[6-(4-chloro-2-cyclohexyl-phenoxy)-3-pyridyl]carbamoyl]cyclopropanecarboxylate Formula: C22H22ClN2O4- MolecularWeight: 413.87408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C=CC(=C2)Cl)OC3=NC=C(C=C3)NC(=O)C4CC4C(=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=C(C=CC(=C2)Cl)OC3=NC=C(C=C3)NC(=O)[C@@H]4C[C@@H]4C(=O)[O-]

InChI

InChI=1S/C22H23ClN2O4/c23-14-6-8-19(16(10-14)13-4-2-1-3-5-13)29-20-9-7-15(12-24-20)25-21(26)17-11-18(17)22(27)28/h6-10,12-13,17-18H,1-5,11H2,(H,25,26)(H,27,28)/p-1/t17-,18+/m1/s1