N-(1,3-benzodioxol-5-yl)-2-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[4-(3-fluoro-4-methoxy-benzyl)piperazino]propionamide Formula: C22H26FN3O4 MolecularWeight: 415.457943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)N3CCN(CC3)CC4=CC(=C(C=C4)OC)F

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCO2)N3CCN(CC3)CC4=CC(=C(C=C4)OC)F

InChI

InChI=1S/C22H26FN3O4/c1-15(22(27)24-17-4-6-20-21(12-17)30-14-29-20)26-9-7-25(8-10-26)13-16-3-5-19(28-2)18(23)11-16/h3-6,11-12,15H,7-10,13-14H2,1-2H3,(H,24,27)