4-(2-chloranyl-4-fluoranyl-phenyl)carbonyl-6-methoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 4-(2-chloranyl-4-fluoranyl-phenyl)carbonyl-6-methoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 4-(2-chloro-4-fluoro-benzoyl)-6-methoxy-1-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 4-[(2-chloro-4-fluorophenyl)-oxomethyl]-6-methoxy-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 4-(2-chloro-4-fluorobenzoyl)-6-methoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 4-(2-chloro-4-fluoro-benzoyl)-6-methoxy-1-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C19H19ClFN3O3 MolecularWeight: 391.823863

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CC(=O)N(C1)CC2=CN=CC=C2)C(=O)C3=C(C=C(C=C3)F)Cl

Isomeric SMILES

COC1CN(CC(=O)N(C1)CC2=CN=CC=C2)C(=O)C3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C19H19ClFN3O3/c1-27-15-10-23(9-13-3-2-6-22-8-13)18(25)12-24(11-15)19(26)16-5-4-14(21)7-17(16)20/h2-8,15H,9-12H2,1H3