3-[[1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl]amino]benzamide

Systemtic Name: 3-[[1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl]amino]benzamide Openeye Name: 3-[[2-(1-adamantylamino)-1-methyl-2-oxo-ethyl]amino]benzamide CAS Name: 3-[[1-(1-adamantylamino)-1-oxopropan-2-yl]amino]benzamide IUPAC Name: 3-[[1-(1-adamantylamino)-1-oxopropan-2-yl]amino]benzamide Traditional Name: 3-[[2-(1-adamantylamino)-2-keto-1-methyl-ethyl]amino]benzamide Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)NC4=CC=CC(=C4)C(=O)N

Isomeric SMILES

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)NC4=CC=CC(=C4)C(=O)N

InChI

InChI=1S/C20H27N3O2/c1-12(22-17-4-2-3-16(8-17)18(21)24)19(25)23-20-9-13-5-14(10-20)7-15(6-13)11-20/h2-4,8,12-15,22H,5-7,9-11H2,1H3,(H2,21,24)(H,23,25)