2-[4-[4-(4-carbamimidoylphenyl)-2-methyl-4-oxidanylidene-butanoyl]phenoxy]ethanoate

Systemtic Name: 2-[4-[4-(4-carbamimidoylphenyl)-2-methyl-4-oxidanylidene-butanoyl]phenoxy]ethanoate Openeye Name: 2-[4-[4-(4-carbamimidoylphenyl)-2-methyl-4-oxo-butanoyl]phenoxy]acetate CAS Name: 2-[4-[4-(4-carbamimidoylphenyl)-2-methyl-1,4-dioxobutyl]phenoxy]acetate IUPAC Name: 2-[4-[4-(4-carbamimidoylphenyl)-2-methyl-4-oxobutanoyl]phenoxy]acetate Traditional Name: 2-[4-[4-(4-amidinophenyl)-4-keto-2-methyl-butanoyl]phenoxy]acetate Formula: C20H19N2O5- MolecularWeight: 367.37526

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=CC=C(C=C1)C(=N)N)C(=O)C2=CC=C(C=C2)OCC(=O)[O-]

Isomeric SMILES

CC(CC(=O)C1=CC=C(C=C1)C(=N)N)C(=O)C2=CC=C(C=C2)OCC(=O)[O-]

InChI

InChI=1S/C20H20N2O5/c1-12(10-17(23)13-2-4-15(5-3-13)20(21)22)19(26)14-6-8-16(9-7-14)27-11-18(24)25/h2-9,12H,10-11H2,1H3,(H3,21,22)(H,24,25)/p-1