3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]propanenitrile

Systemtic Name: 3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]propanenitrile Openeye Name: 3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]propanenitrile CAS Name: 3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-2,5-dioxo-1-imidazolidinyl]propanenitrile IUPAC Name: 3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]propanenitrile Traditional Name: 3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2,5-diketo-4-methyl-imidazolidin-1-yl]propionitrile Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)CCC#N)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1(C(=O)N(C(=O)N1)CCC#N)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H17N3O4/c1-16(14(20)19(7-2-6-17)15(21)18-16)11-4-5-12-13(10-11)23-9-3-8-22-12/h4-5,10H,2-3,7-9H2,1H3,(H,18,21)