[4-[2-[[2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-(oxidanylamino)-1-oxidanylidene-propan-2-yl]-4-methyl-pentanoyl]amino]-3-(methylamino)-3-oxidanylidene-propyl]phenoxy]methanesulfonic acid

Systemtic Name: [4-[2-[[2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-(oxidanylamino)-1-oxidanylidene-propan-2-yl]-4-methyl-pentanoyl]amino]-3-(methylamino)-3-oxidanylidene-propyl]phenoxy]methanesulfonic acid Openeye Name: [4-[2-[[2-[1-[(1,3-dioxoisoindolin-2-yl)methyl]-2-(hydroxyamino)-2-oxo-ethyl]-4-methyl-pentanoyl]amino]-3-(methylamino)-3-oxo-propyl]phenoxy]methanesulfonic acid CAS Name: [4-[2-[[2-[3-(1,3-dioxo-2-isoindolyl)-1-(hydroxyamino)-1-oxopropan-2-yl]-4-methyl-1-oxopentyl]amino]-3-(methylamino)-3-oxopropyl]phenoxy]methanesulfonic acid IUPAC Name: [4-[2-[[2-[3-(1,3-dioxoisoindol-2-yl)-1-(hydroxyamino)-1-oxopropan-2-yl]-4-methylpentanoyl]amino]-3-(methylamino)-3-oxopropyl]phenoxy]methanesulfonic acid Traditional Name: [4-[2-[[2-[2-(hydroxyamino)-2-keto-1-(phthalimidomethyl)ethyl]-4-methyl-pentanoyl]amino]-3-keto-3-(methylamino)propyl]phenoxy]methanesulfonic acid Formula: C28H34N4O10S MolecularWeight: 618.65536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CN1C(=O)C2=CC=CC=C2C1=O)C(=O)NO)C(=O)NC(CC3=CC=C(C=C3)OCS(=O)(=O)O)C(=O)NC

Isomeric SMILES

CC(C)CC(C(CN1C(=O)C2=CC=CC=C2C1=O)C(=O)NO)C(=O)NC(CC3=CC=C(C=C3)OCS(=O)(=O)O)C(=O)NC

InChI

InChI=1S/C28H34N4O10S/c1-16(2)12-21(22(25(34)31-38)14-32-27(36)19-6-4-5-7-20(19)28(32)37)24(33)30-23(26(35)29-3)13-17-8-10-18(11-9-17)42-15-43(39,40)41/h4-11,16,21-23,38H,12-15H2,1-3H3,(H,29,35)(H,30,33)(H,31,34)(H,39,40,41)