N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)-2-methyl-propyl]adamantane-1-carboxamide Formula: C25H34N2O4 MolecularWeight: 426.54846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC2=C(C=C1)OCCCO2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)C(C(=O)NC1=CC2=C(C=C1)OCCCO2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H34N2O4/c1-15(2)22(23(28)26-19-4-5-20-21(11-19)31-7-3-6-30-20)27-24(29)25-12-16-8-17(13-25)10-18(9-16)14-25/h4-5,11,15-18,22H,3,6-10,12-14H2,1-2H3,(H,26,28)(H,27,29)