[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 3-acetamido-3-(4-methoxyphenyl)propanoate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 3-acetamido-3-(4-methoxyphenyl)propanoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 3-acetamido-3-(4-methoxyphenyl)propanoate CAS Name: 3-acetamido-3-(4-methoxyphenyl)propanoic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 3-acetamido-3-(4-methoxyphenyl)propanoate Traditional Name: 3-acetamido-3-(4-methoxyphenyl)propionic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C24H32N2O5 MolecularWeight: 428.52128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N2O5/c1-15(27)25-21(19-3-5-20(30-2)6-4-19)10-23(29)31-14-22(28)26-24-11-16-7-17(12-24)9-18(8-16)13-24/h3-6,16-18,21H,7-14H2,1-2H3,(H,25,27)(H,26,28)