methyl (2S)-3-(1H-indol-3-yl)-2-[[8-(oxidanylamino)-8-oxidanylidene-octanoyl]amino]propanoate

Systemtic Name: methyl (2S)-3-(1H-indol-3-yl)-2-[[8-(oxidanylamino)-8-oxidanylidene-octanoyl]amino]propanoate Openeye Name: methyl (2S)-2-[[8-(hydroxyamino)-8-oxo-octanoyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-[[8-(hydroxyamino)-1,8-dioxooctyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[8-(hydroxyamino)-8-oxooctanoyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-[[8-(hydroxyamino)-8-keto-octanoyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C20H27N3O5 MolecularWeight: 389.44548

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CCCCCCC(=O)NO

Isomeric SMILES

COC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)CCCCCCC(=O)NO

InChI

InChI=1S/C20H27N3O5/c1-28-20(26)17(12-14-13-21-16-9-7-6-8-15(14)16)22-18(24)10-4-2-3-5-11-19(25)23-27/h6-9,13,17,21,27H,2-5,10-12H2,1H3,(H,22,24)(H,23,25)/t17-/m0/s1