4-[(4-carbamimidoylphenyl)carbonylamino]-3-oxidanylidene-2-phenoxy-pentanoic acid

Systemtic Name: 4-[(4-carbamimidoylphenyl)carbonylamino]-3-oxidanylidene-2-phenoxy-pentanoic acid Openeye Name: 4-[(4-carbamimidoylbenzoyl)amino]-3-oxo-2-phenoxy-pentanoic acid CAS Name: 4-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-3-oxo-2-phenoxypentanoic acid IUPAC Name: 4-[(4-carbamimidoylbenzoyl)amino]-3-oxo-2-phenoxypentanoic acid Traditional Name: 4-[(4-amidinobenzoyl)amino]-3-keto-2-phenoxy-valeric acid Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C(=O)O)OC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC(C(=O)C(C(=O)O)OC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C19H19N3O5/c1-11(22-18(24)13-9-7-12(8-10-13)17(20)21)15(23)16(19(25)26)27-14-5-3-2-4-6-14/h2-11,16H,1H3,(H3,20,21)(H,22,24)(H,25,26)