1-[4-(2-fluorophenyl)phenyl]carbonyl-4-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one

Systemtic Name: 1-[4-(2-fluorophenyl)phenyl]carbonyl-4-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one Openeye Name: 1-[4-(2-fluorophenyl)benzoyl]-4-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one CAS Name: 1-[[4-(2-fluorophenyl)phenyl]-oxomethyl]-4-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one IUPAC Name: 1-[4-(2-fluorophenyl)benzoyl]-4-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one Traditional Name: 1-[4-(2-fluorophenyl)benzoyl]-4-m-anisyl-1,4-diazepan-5-one Formula: C26H25FN2O3 MolecularWeight: 432.486703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CCN(CCC2=O)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4F

Isomeric SMILES

COC1=CC=CC(=C1)CN2CCN(CCC2=O)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4F

InChI

InChI=1S/C26H25FN2O3/c1-32-22-6-4-5-19(17-22)18-29-16-15-28(14-13-25(29)30)26(31)21-11-9-20(10-12-21)23-7-2-3-8-24(23)27/h2-12,17H,13-16,18H2,1H3