2-[3-chloranyl-5-[cyclohexyl(methyl)carbamoyl]phenoxy]ethyl-pyridin-4-yl-carbamic acid

Systemtic Name: 2-[3-chloranyl-5-[cyclohexyl(methyl)carbamoyl]phenoxy]ethyl-pyridin-4-yl-carbamic acid Openeye Name: 2-[3-chloro-5-[cyclohexyl(methyl)carbamoyl]phenoxy]ethyl-(4-pyridyl)carbamic acid CAS Name: 2-[3-chloro-5-[[cyclohexyl(methyl)amino]-oxomethyl]phenoxy]ethyl-pyridin-4-ylcarbamic acid IUPAC Name: 2-[3-chloro-5-[cyclohexyl(methyl)carbamoyl]phenoxy]ethyl-pyridin-4-ylcarbamic acid Traditional Name: 2-[3-chloro-5-[cyclohexyl(methyl)carbamoyl]phenoxy]ethyl-(4-pyridyl)carbamic acid Formula: C22H26ClN3O4 MolecularWeight: 431.91254

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)C2=CC(=CC(=C2)Cl)OCCN(C3=CC=NC=C3)C(=O)O

Isomeric SMILES

CN(C1CCCCC1)C(=O)C2=CC(=CC(=C2)Cl)OCCN(C3=CC=NC=C3)C(=O)O

InChI

InChI=1S/C22H26ClN3O4/c1-25(18-5-3-2-4-6-18)21(27)16-13-17(23)15-20(14-16)30-12-11-26(22(28)29)19-7-9-24-10-8-19/h7-10,13-15,18H,2-6,11-12H2,1H3,(H,28,29)