methyl 1-(3-chloranyl-4-phenyl-5-pyrrolidin-1-ylcarbonyl-pyridin-2-yl)piperidine-4-carboxylate

Systemtic Name: methyl 1-(3-chloranyl-4-phenyl-5-pyrrolidin-1-ylcarbonyl-pyridin-2-yl)piperidine-4-carboxylate Openeye Name: methyl 1-[3-chloro-4-phenyl-5-(pyrrolidine-1-carbonyl)-2-pyridyl]piperidine-4-carboxylate CAS Name: 1-[3-chloro-5-[oxo(1-pyrrolidinyl)methyl]-4-phenyl-2-pyridinyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-chloro-4-phenyl-5-(pyrrolidine-1-carbonyl)pyridin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[3-chloro-4-phenyl-5-(pyrrolidine-1-carbonyl)-2-pyridyl]isonipecotic acid methyl ester Formula: C23H26ClN3O3 MolecularWeight: 427.92384

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C2=NC=C(C(=C2Cl)C3=CC=CC=C3)C(=O)N4CCCC4

Isomeric SMILES

COC(=O)C1CCN(CC1)C2=NC=C(C(=C2Cl)C3=CC=CC=C3)C(=O)N4CCCC4

InChI

InChI=1S/C23H26ClN3O3/c1-30-23(29)17-9-13-26(14-10-17)21-20(24)19(16-7-3-2-4-8-16)18(15-25-21)22(28)27-11-5-6-12-27/h2-4,7-8,15,17H,5-6,9-14H2,1H3