2-[3-[[bis(azanyl)methylideneamino]-(phenylcarbonyl)amino]-2-phenoxy-phenyl]ethanoate

Systemtic Name: 2-[3-[[bis(azanyl)methylideneamino]-(phenylcarbonyl)amino]-2-phenoxy-phenyl]ethanoate Openeye Name: 2-[3-[benzoyl(guanidino)amino]-2-phenoxy-phenyl]acetate CAS Name: 2-[3-[benzoyl-(diaminomethylideneamino)amino]-2-phenoxyphenyl]acetate IUPAC Name: 2-[3-[benzoyl-(diaminomethylideneamino)amino]-2-phenoxyphenyl]acetate Traditional Name: 2-[3-[benzoyl(guanidino)amino]-2-phenoxy-phenyl]acetate Formula: C22H19N4O4- MolecularWeight: 403.41066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N(C2=CC=CC(=C2OC3=CC=CC=C3)CC(=O)[O-])N=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N(C2=CC=CC(=C2OC3=CC=CC=C3)CC(=O)[O-])N=C(N)N

InChI

InChI=1S/C22H20N4O4/c23-22(24)25-26(21(29)15-8-3-1-4-9-15)18-13-7-10-16(14-19(27)28)20(18)30-17-11-5-2-6-12-17/h1-13H,14H2,(H,27,28)(H4,23,24,25)/p-1