1,3-benzodioxol-5-yl-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-(3-fluoro-4-methoxy-benzyl)piperazino]methanone Formula: C20H21FN2O4 MolecularWeight: 372.390143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCO4)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCO4)F

InChI

InChI=1S/C20H21FN2O4/c1-25-17-4-2-14(10-16(17)21)12-22-6-8-23(9-7-22)20(24)15-3-5-18-19(11-15)27-13-26-18/h2-5,10-11H,6-9,12-13H2,1H3