2-[[3,4-bis(oxidanylidene)-1-(4-phenylazanylfuran-3-yl)pentan-2-yl]-methyl-amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[3,4-bis(oxidanylidene)-1-(4-phenylazanylfuran-3-yl)pentan-2-yl]-methyl-amino]-4-methyl-pentanoic acid Openeye Name: 2-[[1-[(4-anilino-3-furyl)methyl]-2,3-dioxo-butyl]-methyl-amino]-4-methyl-pentanoic acid CAS Name: 2-[[1-(4-anilino-3-furanyl)-3,4-dioxopentan-2-yl]-methylamino]-4-methylpentanoic acid IUPAC Name: 2-[[1-(4-anilinofuran-3-yl)-3,4-dioxopentan-2-yl]-methylamino]-4-methylpentanoic acid Traditional Name: 2-[[1-[(4-anilino-3-furyl)methyl]-2,3-diketo-butyl]-methyl-amino]-4-methyl-valeric acid Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(C)C(CC1=COC=C1NC2=CC=CC=C2)C(=O)C(=O)C

Isomeric SMILES

CC(C)CC(C(=O)O)N(C)C(CC1=COC=C1NC2=CC=CC=C2)C(=O)C(=O)C

InChI

InChI=1S/C22H28N2O5/c1-14(2)10-20(22(27)28)24(4)19(21(26)15(3)25)11-16-12-29-13-18(16)23-17-8-6-5-7-9-17/h5-9,12-14,19-20,23H,10-11H2,1-4H3,(H,27,28)