6-chloranyl-N-prop-2-ynyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-prop-2-ynyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-prop-2-ynyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-prop-2-ynyl-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-prop-2-ynyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-propargyl-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C13H12ClNO3 MolecularWeight: 265.69228

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)C1=CC2=C(C(=C1)Cl)OCCCO2

Isomeric SMILES

C#CCNC(=O)C1=CC2=C(C(=C1)Cl)OCCCO2

InChI

InChI=1S/C13H12ClNO3/c1-2-4-15-13(16)9-7-10(14)12-11(8-9)17-5-3-6-18-12/h1,7-8H,3-6H2,(H,15,16)