methyl 4-[2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]ethanoylamino]butanoate

Systemtic Name: methyl 4-[2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]ethanoylamino]butanoate Openeye Name: methyl 4-[[2-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]acetyl]amino]butanoate CAS Name: 4-[[2-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]acetyl]amino]butanoate Traditional Name: 4-[[2-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]acetyl]amino]butyric acid methyl ester Formula: C17H23N5O4 MolecularWeight: 361.39562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)CN1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

COC(=O)CCCNC(=O)CN1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C17H23N5O4/c1-26-15(24)3-2-8-20-14(23)11-21-9-10-22(17(21)25)13-6-4-12(5-7-13)16(18)19/h4-7H,2-3,8-11H2,1H3,(H3,18,19)(H,20,23)