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

Systemtic Name: 2-[3-chloranyl-5-[2-cyanoethyl(cyclopentyl)carbamoyl]phenoxy]ethyl-pyridin-4-yl-carbamic acid Openeye Name: 2-[3-chloro-5-[2-cyanoethyl(cyclopentyl)carbamoyl]phenoxy]ethyl-(4-pyridyl)carbamic acid CAS Name: 2-[3-chloro-5-[[2-cyanoethyl(cyclopentyl)amino]-oxomethyl]phenoxy]ethyl-pyridin-4-ylcarbamic acid IUPAC Name: 2-[3-chloro-5-[2-cyanoethyl(cyclopentyl)carbamoyl]phenoxy]ethyl-pyridin-4-ylcarbamic acid Traditional Name: 2-[3-chloro-5-[2-cyanoethyl(cyclopentyl)carbamoyl]phenoxy]ethyl-(4-pyridyl)carbamic acid Formula: C23H25ClN4O4 MolecularWeight: 456.922

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CCC#N)C(=O)C2=CC(=CC(=C2)Cl)OCCN(C3=CC=NC=C3)C(=O)O

Isomeric SMILES

C1CCC(C1)N(CCC#N)C(=O)C2=CC(=CC(=C2)Cl)OCCN(C3=CC=NC=C3)C(=O)O

InChI

InChI=1S/C23H25ClN4O4/c24-18-14-17(22(29)27(11-3-8-25)19-4-1-2-5-19)15-21(16-18)32-13-12-28(23(30)31)20-6-9-26-10-7-20/h6-7,9-10,14-16,19H,1-5,11-13H2,(H,30,31)