2-[3-chloranyl-5-[2-cyanoethyl(oxolan-2-ylmethyl)carbamoyl]phenoxy]ethyl-pyridin-4-yl-carbamic acid

Systemtic Name: 2-[3-chloranyl-5-[2-cyanoethyl(oxolan-2-ylmethyl)carbamoyl]phenoxy]ethyl-pyridin-4-yl-carbamic acid Openeye Name: 2-[3-chloro-5-[2-cyanoethyl(tetrahydrofuran-2-ylmethyl)carbamoyl]phenoxy]ethyl-(4-pyridyl)carbamic acid CAS Name: 2-[3-chloro-5-[[2-cyanoethyl(2-oxolanylmethyl)amino]-oxomethyl]phenoxy]ethyl-pyridin-4-ylcarbamic acid IUPAC Name: 2-[3-chloro-5-[2-cyanoethyl(oxolan-2-ylmethyl)carbamoyl]phenoxy]ethyl-pyridin-4-ylcarbamic acid Traditional Name: 2-[3-chloro-5-[2-cyanoethyl(tetrahydrofurfuryl)carbamoyl]phenoxy]ethyl-(4-pyridyl)carbamic acid Formula: C23H25ClN4O5 MolecularWeight: 472.9214

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CCC#N)C(=O)C2=CC(=CC(=C2)Cl)OCCN(C3=CC=NC=C3)C(=O)O

Isomeric SMILES

C1CC(OC1)CN(CCC#N)C(=O)C2=CC(=CC(=C2)Cl)OCCN(C3=CC=NC=C3)C(=O)O

InChI

InChI=1S/C23H25ClN4O5/c24-18-13-17(22(29)27(9-2-6-25)16-20-3-1-11-32-20)14-21(15-18)33-12-10-28(23(30)31)19-4-7-26-8-5-19/h4-5,7-8,13-15,20H,1-3,9-12,16H2,(H,30,31)