N-(2-chloranyl-4-fluoranyl-phenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide Openeye Name: N-(2-chloro-4-fluoro-phenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide CAS Name: N-(2-chloro-4-fluorophenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide IUPAC Name: N-(2-chloro-4-fluorophenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide Traditional Name: N-(2-chloro-4-fluoro-phenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propionamide Formula: C18H18ClFN2O3 MolecularWeight: 364.798523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)F)Cl)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)F)Cl)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H18ClFN2O3/c1-11(18(23)22-15-5-3-12(20)9-14(15)19)21-13-4-6-16-17(10-13)25-8-2-7-24-16/h3-6,9-11,21H,2,7-8H2,1H3,(H,22,23)