4-azanyl-2-[[3-[(4-carbamimidoylphenyl)carbonylamino]phenyl]carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[[3-[(4-carbamimidoylphenyl)carbonylamino]phenyl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[[3-[(4-carbamimidoylbenzoyl)amino]benzoyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[[3-[[(4-carbamimidoylphenyl)-oxomethyl]amino]phenyl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[[3-[(4-carbamimidoylbenzoyl)amino]benzoyl]amino]-4-oxobutanoic acid Traditional Name: 2-[[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)N)C(=O)O

Isomeric SMILES

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

InChI

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