1,3-benzodioxol-5-yl-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-(4-fluorobenzyl)-1,4-diazepan-1-yl]methanone Formula: C20H21FN2O3 MolecularWeight: 356.390743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC3=C(C=C2)OCO3)CC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC3=C(C=C2)OCO3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C20H21FN2O3/c21-17-5-2-15(3-6-17)13-22-8-1-9-23(11-10-22)20(24)16-4-7-18-19(12-16)26-14-25-18/h2-7,12H,1,8-11,13-14H2