propan-2-yl (2S)-2-[2-(oxidanylcarbamoyl)octanoylamino]-3-phenyl-propanoate

Systemtic Name: propan-2-yl (2S)-2-[2-(oxidanylcarbamoyl)octanoylamino]-3-phenyl-propanoate Openeye Name: isopropyl (2S)-2-[2-(hydroxycarbamoyl)octanoylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-[(hydroxyamino)-oxomethyl]-1-oxooctyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S)-2-[2-(hydroxycarbamoyl)octanoylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[2-(hydroxycarbamoyl)octanoylamino]-3-phenyl-propionic acid isopropyl ester Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)NC(CC1=CC=CC=C1)C(=O)OC(C)C)C(=O)NO

Isomeric SMILES

CCCCCCC(C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OC(C)C)C(=O)NO

InChI

InChI=1S/C21H32N2O5/c1-4-5-6-10-13-17(20(25)23-27)19(24)22-18(21(26)28-15(2)3)14-16-11-8-7-9-12-16/h7-9,11-12,15,17-18,27H,4-6,10,13-14H2,1-3H3,(H,22,24)(H,23,25)/t17?,18-/m0/s1