2-(1-adamantyl)-1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]ethanone

Systemtic Name: 2-(1-adamantyl)-1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]ethanone Openeye Name: 2-(1-adamantyl)-1-[4-[(5-methylisoxazol-3-yl)methyl]-1,4-diazepan-1-yl]ethanone CAS Name: 2-(1-adamantyl)-1-[4-[(5-methyl-3-isoxazolyl)methyl]-1,4-diazepan-1-yl]ethanone IUPAC Name: 2-(1-adamantyl)-1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]ethanone Traditional Name: 2-(1-adamantyl)-1-[4-[(5-methylisoxazol-3-yl)methyl]-1,4-diazepan-1-yl]ethanone Formula: C22H33N3O2 MolecularWeight: 371.51632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN2CCCN(CC2)C(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC(=NO1)CN2CCCN(CC2)C(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H33N3O2/c1-16-7-20(23-27-16)15-24-3-2-4-25(6-5-24)21(26)14-22-11-17-8-18(12-22)10-19(9-17)13-22/h7,17-19H,2-6,8-15H2,1H3