[2-(1-adamantylcarbamoylamino)-2-oxidanylidene-ethyl] 3-phenoxypropanoate

Systemtic Name: [2-(1-adamantylcarbamoylamino)-2-oxidanylidene-ethyl] 3-phenoxypropanoate Openeye Name: [2-(1-adamantylcarbamoylamino)-2-oxo-ethyl] 3-phenoxypropanoate CAS Name: 3-phenoxypropanoic acid [2-[[(1-adamantylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylcarbamoylamino)-2-oxoethyl] 3-phenoxypropanoate Traditional Name: 3-phenoxypropionic acid [2-(1-adamantylcarbamoylamino)-2-keto-ethyl] ester Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)COC(=O)CCOC4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)COC(=O)CCOC4=CC=CC=C4

InChI

InChI=1S/C22H28N2O5/c25-19(14-29-20(26)6-7-28-18-4-2-1-3-5-18)23-21(27)24-22-11-15-8-16(12-22)10-17(9-15)13-22/h1-5,15-17H,6-14H2,(H2,23,24,25,27)