4-[(4-fluorophenyl)methyl]-1-[4-(4-hydroxyphenyl)butan-2-yl]-1,4-diazepan-5-one

Systemtic Name: 4-[(4-fluorophenyl)methyl]-1-[4-(4-hydroxyphenyl)butan-2-yl]-1,4-diazepan-5-one Openeye Name: 4-[(4-fluorophenyl)methyl]-1-[3-(4-hydroxyphenyl)-1-methyl-propyl]-1,4-diazepan-5-one CAS Name: 4-[(4-fluorophenyl)methyl]-1-[4-(4-hydroxyphenyl)butan-2-yl]-1,4-diazepan-5-one IUPAC Name: 4-[(4-fluorophenyl)methyl]-1-[4-(4-hydroxyphenyl)butan-2-yl]-1,4-diazepan-5-one Traditional Name: 4-(4-fluorobenzyl)-1-[3-(4-hydroxyphenyl)-1-methyl-propyl]-1,4-diazepan-5-one Formula: C22H27FN2O2 MolecularWeight: 370.460383

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)O)N2CCC(=O)N(CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CC(CCC1=CC=C(C=C1)O)N2CCC(=O)N(CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C22H27FN2O2/c1-17(2-3-18-6-10-21(26)11-7-18)24-13-12-22(27)25(15-14-24)16-19-4-8-20(23)9-5-19/h4-11,17,26H,2-3,12-16H2,1H3