N-[4-[2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanoylamino]phenyl]-2-methyl-propanamide

Systemtic Name: N-[4-[2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanoylamino]phenyl]-2-methyl-propanamide Openeye Name: N-[4-[[2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetyl]amino]phenyl]-2-methyl-propanamide CAS Name: N-[4-[[2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-oxoethyl]amino]phenyl]-2-methylpropanamide IUPAC Name: N-[4-[[2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetyl]amino]phenyl]-2-methylpropanamide Traditional Name: N-[4-[[2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetyl]amino]phenyl]-2-methyl-propionamide Formula: C21H23ClN2O4 MolecularWeight: 402.87132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)CC2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)CC2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C21H23ClN2O4/c1-13(2)21(26)24-16-6-4-15(5-7-16)23-19(25)12-14-10-17(22)20-18(11-14)27-8-3-9-28-20/h4-7,10-11,13H,3,8-9,12H2,1-2H3,(H,23,25)(H,24,26)