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

Systemtic Name: 2-[3-chloranyl-5-(2-methylpiperidin-1-yl)carbonyl-phenoxy]ethyl-pyridin-4-yl-carbamic acid Openeye Name: 2-[3-chloro-5-(2-methylpiperidine-1-carbonyl)phenoxy]ethyl-(4-pyridyl)carbamic acid CAS Name: 2-[3-chloro-5-[(2-methyl-1-piperidinyl)-oxomethyl]phenoxy]ethyl-pyridin-4-ylcarbamic acid IUPAC Name: 2-[3-chloro-5-(2-methylpiperidine-1-carbonyl)phenoxy]ethyl-pyridin-4-ylcarbamic acid Traditional Name: 2-[3-chloro-5-(2-methylpiperidine-1-carbonyl)phenoxy]ethyl-(4-pyridyl)carbamic acid Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=CC(=CC(=C2)Cl)OCCN(C3=CC=NC=C3)C(=O)O

Isomeric SMILES

CC1CCCCN1C(=O)C2=CC(=CC(=C2)Cl)OCCN(C3=CC=NC=C3)C(=O)O

InChI

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