6-chloranyl-N-[(2-methoxypyridin-3-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-[(2-methoxypyridin-3-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-[(2-methoxy-3-pyridyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-[(2-methoxy-3-pyridinyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-[(2-methoxypyridin-3-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[(2-methoxy-3-pyridyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C17H17ClN2O4 MolecularWeight: 348.78088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)CNC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

COC1=C(C=CC=N1)CNC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C17H17ClN2O4/c1-22-17-11(4-2-5-19-17)10-20-16(21)12-8-13(18)15-14(9-12)23-6-3-7-24-15/h2,4-5,8-9H,3,6-7,10H2,1H3,(H,20,21)