methyl 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)benzoate

Systemtic Name: methyl 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)benzoate Openeye Name: methyl 2-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)benzoate CAS Name: 2-[[3,4-dihydro-2H-1,5-benzodioxepin-7-yl(oxo)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)benzoate Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-carbonylamino)benzoic acid methyl ester Formula: C18H17NO5 MolecularWeight: 327.33128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H17NO5/c1-22-18(21)13-5-2-3-6-14(13)19-17(20)12-7-8-15-16(11-12)24-10-4-9-23-15/h2-3,5-8,11H,4,9-10H2,1H3,(H,19,20)