2-[[5-(3-carbamimidoylphenyl)-5-(4-carbamimidoylphenyl)pentanoyl]amino]ethanoic acid

Systemtic Name: 2-[[5-(3-carbamimidoylphenyl)-5-(4-carbamimidoylphenyl)pentanoyl]amino]ethanoic acid Openeye Name: 2-[[5-(3-carbamimidoylphenyl)-5-(4-carbamimidoylphenyl)pentanoyl]amino]acetic acid CAS Name: 2-[[5-(3-carbamimidoylphenyl)-5-(4-carbamimidoylphenyl)-1-oxopentyl]amino]acetic acid IUPAC Name: 2-[[5-(3-carbamimidoylphenyl)-5-(4-carbamimidoylphenyl)pentanoyl]amino]acetic acid Traditional Name: 2-[[5-(3-amidinophenyl)-5-(4-amidinophenyl)pentanoyl]amino]acetic acid Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(CCCC(=O)NCC(=O)O)C2=CC=C(C=C2)C(=N)N)C(=N)N

Isomeric SMILES

C1=CC(=CC(=C1)C(CCCC(=O)NCC(=O)O)C2=CC=C(C=C2)C(=N)N)C(=N)N

InChI

InChI=1S/C21H25N5O3/c22-20(23)14-9-7-13(8-10-14)17(5-2-6-18(27)26-12-19(28)29)15-3-1-4-16(11-15)21(24)25/h1,3-4,7-11,17H,2,5-6,12H2,(H3,22,23)(H3,24,25)(H,26,27)(H,28,29)