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2,3-diaminocarbonyl-4,5-dicarbamimidoyl-6-phenoxy-benzoic acid

2,3-diaminocarbonyl-4,5-dicarbamimidoyl-6-phenoxy-benzoic acid

Systemtic Name:2,3-diaminocarbonyl-4,5-dicarbamimidoyl-6-phenoxy-benzoic acid
Openeye Name:4,5-dicarbamimidoyl-2,3-dicarbamoyl-6-phenoxy-benzoic acid
CAS Name:4,5-dicarbamimidoyl-2,3-dicarbamoyl-6-phenoxybenzoic acid
IUPAC Name:4,5-dicarbamimidoyl-2,3-dicarbamoyl-6-phenoxybenzoic acid
Traditional Name:4,5-diamidino-2,3-dicarbamoyl-6-phenoxy-benzoic acid
Formula: C17H16N6O5
MolecularWeight: 384.34614
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C(=C(C(=C2C(=O)O)C(=O)N)C(=O)N)C(=N)N)C(=N)N


Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C(=C(C(=C2C(=O)O)C(=O)N)C(=O)N)C(=N)N)C(=N)N


InChI

InChI=1S/C17H16N6O5/c18-13(19)7-8(15(22)24)9(16(23)25)11(17(26)27)12(10(7)14(20)21)28-6-4-2-1-3-5-6/h1-5H,(H3,18,19)(H3,20,21)(H2,22,24)(H2,23,25)(H,26,27)


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