N-(4-chloranyl-2,5-dimethoxy-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C18H18ClNO5 MolecularWeight: 363.79222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC3=C(C=C2)OCCCO3)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC3=C(C=C2)OCCCO3)OC)Cl

InChI

InChI=1S/C18H18ClNO5/c1-22-15-10-13(16(23-2)9-12(15)19)20-18(21)11-4-5-14-17(8-11)25-7-3-6-24-14/h4-5,8-10H,3,6-7H2,1-2H3,(H,20,21)