3-[[(E)-4-[(4-carbamimidoylphenyl)amino]-4-oxidanylidene-but-2-enoyl]amino]propanoic acid

Systemtic Name: 3-[[(E)-4-[(4-carbamimidoylphenyl)amino]-4-oxidanylidene-but-2-enoyl]amino]propanoic acid Openeye Name: 3-[[(E)-4-(4-carbamimidoylanilino)-4-oxo-but-2-enoyl]amino]propanoic acid CAS Name: 3-[[(E)-4-(4-carbamimidoylanilino)-1,4-dioxobut-2-enyl]amino]propanoic acid IUPAC Name: 3-[[(E)-4-(4-carbamimidoylanilino)-4-oxobut-2-enoyl]amino]propanoic acid Traditional Name: 3-[[(E)-4-(4-amidinoanilino)-4-keto-but-2-enoyl]amino]propionic acid Formula: C14H16N4O4 MolecularWeight: 304.30124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=N)N)NC(=O)C=CC(=O)NCCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=N)N)NC(=O)/C=C/C(=O)NCCC(=O)O

InChI

InChI=1S/C14H16N4O4/c15-14(16)9-1-3-10(4-2-9)18-12(20)6-5-11(19)17-8-7-13(21)22/h1-6H,7-8H2,(H3,15,16)(H,17,19)(H,18,20)(H,21,22)/b6-5+