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

Systemtic Name: methyl 3-[3-[4-(4-carbamimidoylphenyl)-2,3-dimethyl-phenyl]-2-oxidanylidene-imidazolidin-1-yl]propanoate Openeye Name: methyl 3-[3-[4-(4-carbamimidoylphenyl)-2,3-dimethyl-phenyl]-2-oxo-imidazolidin-1-yl]propanoate CAS Name: 3-[3-[4-(4-carbamimidoylphenyl)-2,3-dimethylphenyl]-2-oxo-1-imidazolidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-[4-(4-carbamimidoylphenyl)-2,3-dimethylphenyl]-2-oxoimidazolidin-1-yl]propanoate Traditional Name: 3-[3-[4-(4-amidinophenyl)-2,3-dimethyl-phenyl]-2-keto-imidazolidin-1-yl]propionic acid methyl ester Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)N2CCN(C2=O)CCC(=O)OC)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC1=C(C=CC(=C1C)N2CCN(C2=O)CCC(=O)OC)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H26N4O3/c1-14-15(2)19(26-13-12-25(22(26)28)11-10-20(27)29-3)9-8-18(14)16-4-6-17(7-5-16)21(23)24/h4-9H,10-13H2,1-3H3,(H3,23,24)