3-[3-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]propanoylamino]-4-oxidanylidene-2-piperidin-1-yl-butanoic acid

Systemtic Name: 3-[3-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]propanoylamino]-4-oxidanylidene-2-piperidin-1-yl-butanoic acid Openeye Name: 3-[3-(1-tert-butoxycarbonyl-4-piperidyl)propanoylamino]-4-oxo-2-(1-piperidyl)butanoic acid CAS Name: 3-[[3-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-piperidinyl]-1-oxopropyl]amino]-4-oxo-2-(1-piperidinyl)butanoic acid IUPAC Name: 3-[3-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]propanoylamino]-4-oxo-2-piperidin-1-ylbutanoic acid Traditional Name: 3-[3-(1-tert-butoxycarbonyl-4-piperidyl)propanoylamino]-4-keto-2-piperidino-butyric acid Formula: C22H37N3O6 MolecularWeight: 439.54568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCC(=O)NC(C=O)C(C(=O)O)N2CCCCC2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCC(=O)NC(C=O)C(C(=O)O)N2CCCCC2

InChI

InChI=1S/C22H37N3O6/c1-22(2,3)31-21(30)25-13-9-16(10-14-25)7-8-18(27)23-17(15-26)19(20(28)29)24-11-5-4-6-12-24/h15-17,19H,4-14H2,1-3H3,(H,23,27)(H,28,29)