2-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxidanylidene-ethyl]-methyl-amino]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxidanylidene-ethyl]-methyl-amino]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxo-ethyl]-methyl-amino]-N-(p-tolyl)acetamide CAS Name: 2-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl]-methylamino]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl]-methylamino]-N-(4-methylphenyl)acetamide Traditional Name: 2-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-keto-ethyl]-methyl-amino]-N-(p-tolyl)acetamide Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)CC(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)CC(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C21H25N3O4/c1-15-4-6-16(7-5-15)22-20(25)13-24(2)14-21(26)23-17-8-9-18-19(12-17)28-11-3-10-27-18/h4-9,12H,3,10-11,13-14H2,1-2H3,(H,22,25)(H,23,26)