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

Systemtic Name: 2-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxidanylidene-ethyl]amino]-N-(4-methylphenyl)benzamide Openeye Name: 2-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxo-ethyl]amino]-N-(p-tolyl)benzamide CAS Name: 2-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide IUPAC Name: 2-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide Traditional Name: 2-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-keto-ethyl]amino]-N-(p-tolyl)benzamide Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NCC(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NCC(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C25H25N3O4/c1-17-7-9-18(10-8-17)28-25(30)20-5-2-3-6-21(20)26-16-24(29)27-19-11-12-22-23(15-19)32-14-4-13-31-22/h2-3,5-12,15,26H,4,13-14,16H2,1H3,(H,27,29)(H,28,30)