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

Systemtic Name: 6-chloranyl-N-phenethyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-phenethyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-phenethyl-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-phenethyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-phenethyl-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C18H18ClNO3 MolecularWeight: 331.79342

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)NCCC3=CC=CC=C3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)NCCC3=CC=CC=C3)Cl)OC1

InChI

InChI=1S/C18H18ClNO3/c19-15-11-14(12-16-17(15)23-10-4-9-22-16)18(21)20-8-7-13-5-2-1-3-6-13/h1-3,5-6,11-12H,4,7-10H2,(H,20,21)