6-chloranyl-N-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C19H20ClNO6 MolecularWeight: 393.8182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C19H20ClNO6/c1-23-14-9-12(10-15(24-2)18(14)25-3)21-19(22)11-7-13(20)17-16(8-11)26-5-4-6-27-17/h7-10H,4-6H2,1-3H3,(H,21,22)