tert-butyl (3R)-3-[[(2S)-3,3-dimethyl-1-(methylamino)-1-oxidanylidene-butan-2-yl]carbamoyl]-7-phenoxy-heptanoate

Systemtic Name: tert-butyl (3R)-3-[[(2S)-3,3-dimethyl-1-(methylamino)-1-oxidanylidene-butan-2-yl]carbamoyl]-7-phenoxy-heptanoate Openeye Name: tert-butyl (3R)-3-[[(1S)-2,2-dimethyl-1-(methylcarbamoyl)propyl]carbamoyl]-7-phenoxy-heptanoate CAS Name: (3R)-3-[[[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]amino]-oxomethyl]-7-phenoxyheptanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-[[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]-7-phenoxyheptanoate Traditional Name: (3R)-3-[[(1S)-2,2-dimethyl-1-(methylcarbamoyl)propyl]carbamoyl]-7-phenoxy-enanthic acid tert-butyl ester Formula: C25H40N2O5 MolecularWeight: 448.5955

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)NC)NC(=O)C(CCCCOC1=CC=CC=C1)CC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)[C@@H](C(=O)NC)NC(=O)[C@H](CCCCOC1=CC=CC=C1)CC(=O)OC(C)(C)C

InChI

InChI=1S/C25H40N2O5/c1-24(2,3)21(23(30)26-7)27-22(29)18(17-20(28)32-25(4,5)6)13-11-12-16-31-19-14-9-8-10-15-19/h8-10,14-15,18,21H,11-13,16-17H2,1-7H3,(H,26,30)(H,27,29)/t18-,21-/m1/s1