2-[3-chloranyl-5-(2,5-dimethylpyrrolidin-1-yl)carbonyl-phenoxy]ethyl-pyridin-4-yl-carbamic acid

Systemtic Name: 2-[3-chloranyl-5-(2,5-dimethylpyrrolidin-1-yl)carbonyl-phenoxy]ethyl-pyridin-4-yl-carbamic acid Openeye Name: 2-[3-chloro-5-(2,5-dimethylpyrrolidine-1-carbonyl)phenoxy]ethyl-(4-pyridyl)carbamic acid CAS Name: 2-[3-chloro-5-[(2,5-dimethyl-1-pyrrolidinyl)-oxomethyl]phenoxy]ethyl-pyridin-4-ylcarbamic acid IUPAC Name: 2-[3-chloro-5-(2,5-dimethylpyrrolidine-1-carbonyl)phenoxy]ethyl-pyridin-4-ylcarbamic acid Traditional Name: 2-[3-chloro-5-(2,5-dimethylpyrrolidine-1-carbonyl)phenoxy]ethyl-(4-pyridyl)carbamic acid Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(N1C(=O)C2=CC(=CC(=C2)Cl)OCCN(C3=CC=NC=C3)C(=O)O)C

Isomeric SMILES

CC1CCC(N1C(=O)C2=CC(=CC(=C2)Cl)OCCN(C3=CC=NC=C3)C(=O)O)C

InChI

InChI=1S/C21H24ClN3O4/c1-14-3-4-15(2)25(14)20(26)16-11-17(22)13-19(12-16)29-10-9-24(21(27)28)18-5-7-23-8-6-18/h5-8,11-15H,3-4,9-10H2,1-2H3,(H,27,28)