[2-[di(propan-2-yl)amino]-2-oxidanylidene-ethyl] (2R)-2-(1-adamantylcarbonylamino)-3-methyl-butanoate

Systemtic Name: [2-[di(propan-2-yl)amino]-2-oxidanylidene-ethyl] (2R)-2-(1-adamantylcarbonylamino)-3-methyl-butanoate Openeye Name: [2-(diisopropylamino)-2-oxo-ethyl] (2R)-2-(adamantane-1-carbonylamino)-3-methyl-butanoate CAS Name: (2R)-2-[[1-adamantyl(oxo)methyl]amino]-3-methylbutanoic acid [2-[di(propan-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[di(propan-2-yl)amino]-2-oxoethyl] (2R)-2-(adamantane-1-carbonylamino)-3-methylbutanoate Traditional Name: (2R)-2-(adamantane-1-carbonylamino)-3-methyl-butyric acid [2-(diisopropylamino)-2-keto-ethyl] ester Formula: C24H40N2O4 MolecularWeight: 420.5854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)N(C(C)C)C(C)C)NC(=O)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CC(C)[C@H](C(=O)OCC(=O)N(C(C)C)C(C)C)NC(=O)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C24H40N2O4/c1-14(2)21(22(28)30-13-20(27)26(15(3)4)16(5)6)25-23(29)24-10-17-7-18(11-24)9-19(8-17)12-24/h14-19,21H,7-13H2,1-6H3,(H,25,29)/t17?,18?,19?,21-,24?/m1/s1