methyl (2S)-3-(4-bromophenyl)-2-[[8-(oxidanylamino)-8-oxidanylidene-octanoyl]amino]propanoate

Systemtic Name: methyl (2S)-3-(4-bromophenyl)-2-[[8-(oxidanylamino)-8-oxidanylidene-octanoyl]amino]propanoate Openeye Name: methyl (2S)-3-(4-bromophenyl)-2-[[8-(hydroxyamino)-8-oxo-octanoyl]amino]propanoate CAS Name: (2S)-3-(4-bromophenyl)-2-[[8-(hydroxyamino)-1,8-dioxooctyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-bromophenyl)-2-[[8-(hydroxyamino)-8-oxooctanoyl]amino]propanoate Traditional Name: (2S)-3-(4-bromophenyl)-2-[[8-(hydroxyamino)-8-keto-octanoyl]amino]propionic acid methyl ester Formula: C18H25BrN2O5 MolecularWeight: 429.3055

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)Br)NC(=O)CCCCCCC(=O)NO

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)Br)NC(=O)CCCCCCC(=O)NO

InChI

InChI=1S/C18H25BrN2O5/c1-26-18(24)15(12-13-8-10-14(19)11-9-13)20-16(22)6-4-2-3-5-7-17(23)21-25/h8-11,15,25H,2-7,12H2,1H3,(H,20,22)(H,21,23)/t15-/m0/s1