N-[3-[(4-fluorophenyl)methylamino]-2-oxidanyl-propyl]-5-methoxy-2,3-dihydro-1,4-benzodioxine-8-carboxamide

Systemtic Name: N-[3-[(4-fluorophenyl)methylamino]-2-oxidanyl-propyl]-5-methoxy-2,3-dihydro-1,4-benzodioxine-8-carboxamide Openeye Name: N-[3-[(4-fluorophenyl)methylamino]-2-hydroxy-propyl]-5-methoxy-2,3-dihydro-1,4-benzodioxine-8-carboxamide CAS Name: N-[3-[(4-fluorophenyl)methylamino]-2-hydroxypropyl]-5-methoxy-2,3-dihydro-1,4-benzodioxin-8-carboxamide IUPAC Name: N-[3-[(4-fluorophenyl)methylamino]-2-hydroxypropyl]-5-methoxy-2,3-dihydro-1,4-benzodioxine-8-carboxamide Traditional Name: N-[3-[(4-fluorobenzyl)amino]-2-hydroxy-propyl]-5-methoxy-2,3-dihydro-1,4-benzodioxin-8-carboxamide Formula: C20H23FN2O5 MolecularWeight: 390.405423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C(=O)NCC(CNCC3=CC=C(C=C3)F)O)OCCO2

Isomeric SMILES

COC1=C2C(=C(C=C1)C(=O)NCC(CNCC3=CC=C(C=C3)F)O)OCCO2

InChI

InChI=1S/C20H23FN2O5/c1-26-17-7-6-16(18-19(17)28-9-8-27-18)20(25)23-12-15(24)11-22-10-13-2-4-14(21)5-3-13/h2-7,15,22,24H,8-12H2,1H3,(H,23,25)