tert-butyl N-[(E)-[4-(1-adamantylamino)-4-oxidanylidene-butan-2-ylidene]amino]carbamate

Systemtic Name: tert-butyl N-[(E)-[4-(1-adamantylamino)-4-oxidanylidene-butan-2-ylidene]amino]carbamate Openeye Name: tert-butyl N-[(E)-[3-(1-adamantylamino)-1-methyl-3-oxo-propylidene]amino]carbamate CAS Name: N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate Traditional Name: N-[(E)-[3-(1-adamantylamino)-3-keto-1-methyl-propylidene]amino]carbamic acid tert-butyl ester Formula: C19H31N3O3 MolecularWeight: 349.46774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)OC(C)(C)C)CC(=O)NC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

C/C(=N\NC(=O)OC(C)(C)C)/CC(=O)NC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C19H31N3O3/c1-12(21-22-17(24)25-18(2,3)4)5-16(23)20-19-9-13-6-14(10-19)8-15(7-13)11-19/h13-15H,5-11H2,1-4H3,(H,20,23)(H,22,24)/b21-12+