methyl 3-[4-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazol-1-yl]phenyl]-2-oxidanyl-propanoate

Systemtic Name: methyl 3-[4-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazol-1-yl]phenyl]-2-oxidanyl-propanoate Openeye Name: methyl 3-[4-[3-(4-carbamimidoylphenyl)-2-oxo-imidazol-1-yl]phenyl]-2-hydroxy-propanoate CAS Name: 3-[4-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolyl]phenyl]-2-hydroxypropanoic acid methyl ester IUPAC Name: methyl 3-[4-[3-(4-carbamimidoylphenyl)-2-oxoimidazol-1-yl]phenyl]-2-hydroxypropanoate Traditional Name: 3-[4-[3-(4-amidinophenyl)-2-keto-4-imidazolin-1-yl]phenyl]-2-hydroxy-propionic acid methyl ester Formula: C20H20N4O4 MolecularWeight: 380.3972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)N2C=CN(C2=O)C3=CC=C(C=C3)C(=N)N)O

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)N2C=CN(C2=O)C3=CC=C(C=C3)C(=N)N)O

InChI

InChI=1S/C20H20N4O4/c1-28-19(26)17(25)12-13-2-6-15(7-3-13)23-10-11-24(20(23)27)16-8-4-14(5-9-16)18(21)22/h2-11,17,25H,12H2,1H3,(H3,21,22)