N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-(2-keto-1,3-benzoxazol-3-yl)butyramide Formula: C21H21ClN2O5 MolecularWeight: 416.85484

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CNC(=O)CCCN3C4=CC=CC=C4OC3=O)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CNC(=O)CCCN3C4=CC=CC=C4OC3=O)Cl)OC1

InChI

InChI=1S/C21H21ClN2O5/c22-15-11-14(12-18-20(15)28-10-4-9-27-18)13-23-19(25)7-3-8-24-16-5-1-2-6-17(16)29-21(24)26/h1-2,5-6,11-12H,3-4,7-10,13H2,(H,23,25)