propyl 4-[[6-azanyl-5-(5-fluoranyl-2-methoxy-phenyl)carbonyl-pyridin-2-yl]amino]piperidine-1-carboxylate

Systemtic Name: propyl 4-[[6-azanyl-5-(5-fluoranyl-2-methoxy-phenyl)carbonyl-pyridin-2-yl]amino]piperidine-1-carboxylate Openeye Name: propyl 4-[[6-amino-5-(5-fluoro-2-methoxy-benzoyl)-2-pyridyl]amino]piperidine-1-carboxylate CAS Name: 4-[[6-amino-5-[(5-fluoro-2-methoxyphenyl)-oxomethyl]-2-pyridinyl]amino]-1-piperidinecarboxylic acid propyl ester IUPAC Name: propyl 4-[[6-amino-5-(5-fluoro-2-methoxybenzoyl)pyridin-2-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[6-amino-5-(5-fluoro-2-methoxy-benzoyl)-2-pyridyl]amino]piperidine-1-carboxylic acid propyl ester Formula: C22H27FN4O4 MolecularWeight: 430.472583

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)N1CCC(CC1)NC2=NC(=C(C=C2)C(=O)C3=C(C=CC(=C3)F)OC)N

Isomeric SMILES

CCCOC(=O)N1CCC(CC1)NC2=NC(=C(C=C2)C(=O)C3=C(C=CC(=C3)F)OC)N

InChI

InChI=1S/C22H27FN4O4/c1-3-12-31-22(29)27-10-8-15(9-11-27)25-19-7-5-16(21(24)26-19)20(28)17-13-14(23)4-6-18(17)30-2/h4-7,13,15H,3,8-12H2,1-2H3,(H3,24,25,26)