[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] (2S)-2-(furan-2-ylcarbonylamino)-3-methyl-butanoate

Systemtic Name: [2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] (2S)-2-(furan-2-ylcarbonylamino)-3-methyl-butanoate Openeye Name: [2-(1-adamantylmethylamino)-2-oxo-ethyl] (2S)-2-(furan-2-carbonylamino)-3-methyl-butanoate CAS Name: (2S)-2-[[2-furanyl(oxo)methyl]amino]-3-methylbutanoic acid [2-(1-adamantylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylmethylamino)-2-oxoethyl] (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate Traditional Name: (2S)-2-(2-furoylamino)-3-methyl-butyric acid [2-(1-adamantylmethylamino)-2-keto-ethyl] ester Formula: C23H32N2O5 MolecularWeight: 416.51058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NCC12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=CO4

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)NCC12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=CO4

InChI

InChI=1S/C23H32N2O5/c1-14(2)20(25-21(27)18-4-3-5-29-18)22(28)30-12-19(26)24-13-23-9-15-6-16(10-23)8-17(7-15)11-23/h3-5,14-17,20H,6-13H2,1-2H3,(H,24,26)(H,25,27)/t15?,16?,17?,20-,23?/m0/s1