4-azanyl-3-[[3-[(4-carbamimidoylphenyl)carbonylamino]phenyl]carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-3-[[3-[(4-carbamimidoylphenyl)carbonylamino]phenyl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-3-[[3-[(4-carbamimidoylbenzoyl)amino]benzoyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-3-[[[3-[[(4-carbamimidoylphenyl)-oxomethyl]amino]phenyl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-3-[[3-[(4-carbamimidoylbenzoyl)amino]benzoyl]amino]-4-oxobutanoic acid Traditional Name: 3-[[3-[(4-amidinobenzoyl)amino]benzoyl]amino]-4-amino-4-keto-butyric acid Formula: C19H19N5O5 MolecularWeight: 397.38466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)C(=N)N)C(=O)NC(CC(=O)O)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)C(=N)N)C(=O)NC(CC(=O)O)C(=O)N

InChI

InChI=1S/C19H19N5O5/c20-16(21)10-4-6-11(7-5-10)18(28)23-13-3-1-2-12(8-13)19(29)24-14(17(22)27)9-15(25)26/h1-8,14H,9H2,(H3,20,21)(H2,22,27)(H,23,28)(H,24,29)(H,25,26)