methyl 3-[4-[4-(4-carbamimidoylphenyl)-3,5-dimethyl-2-oxidanylidene-imidazol-1-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[4-(4-carbamimidoylphenyl)-3,5-dimethyl-2-oxidanylidene-imidazol-1-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[4-(4-carbamimidoylphenyl)-3,5-dimethyl-2-oxo-imidazol-1-yl]phenyl]propanoate CAS Name: 3-[4-[4-(4-carbamimidoylphenyl)-3,5-dimethyl-2-oxo-1-imidazolyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[4-(4-carbamimidoylphenyl)-3,5-dimethyl-2-oxoimidazol-1-yl]phenyl]propanoate Traditional Name: 3-[4-[4-(4-amidinophenyl)-2-keto-3,5-dimethyl-4-imidazolin-1-yl]phenyl]propionic acid methyl ester Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=O)N1C2=CC=C(C=C2)CCC(=O)OC)C)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC1=C(N(C(=O)N1C2=CC=C(C=C2)CCC(=O)OC)C)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H24N4O3/c1-14-20(16-7-9-17(10-8-16)21(23)24)25(2)22(28)26(14)18-11-4-15(5-12-18)6-13-19(27)29-3/h4-5,7-12H,6,13H2,1-3H3,(H3,23,24)