(phenylmethyl) N-[2-[[2-(1-adamantylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-[[2-(1-adamantylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl]carbamate Openeye Name: benzyl N-[2-[2-(adamantane-1-carbonyl)anilino]-2-oxo-ethyl]carbamate CAS Name: N-[2-[2-[1-adamantyl(oxo)methyl]anilino]-2-oxoethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-[2-(adamantane-1-carbonyl)anilino]-2-oxoethyl]carbamate Traditional Name: N-[2-[2-(adamantane-1-carbonyl)anilino]-2-keto-ethyl]carbamic acid benzyl ester Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)C4=CC=CC=C4NC(=O)CNC(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)C4=CC=CC=C4NC(=O)CNC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C27H30N2O4/c30-24(16-28-26(32)33-17-18-6-2-1-3-7-18)29-23-9-5-4-8-22(23)25(31)27-13-19-10-20(14-27)12-21(11-19)15-27/h1-9,19-21H,10-17H2,(H,28,32)(H,29,30)