(phenylmethyl) N-[1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[2-(1-adamantylamino)-1-methyl-2-oxo-ethyl]carbamate CAS Name: N-[1-(1-adamantylamino)-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(1-adamantylamino)-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-(1-adamantylamino)-2-keto-1-methyl-ethyl]carbamic acid benzyl ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C21H28N2O3/c1-14(22-20(25)26-13-15-5-3-2-4-6-15)19(24)23-21-10-16-7-17(11-21)9-18(8-16)12-21/h2-6,14,16-18H,7-13H2,1H3,(H,22,25)(H,23,24)