3-[2-[(4-carbamimidoylphenyl)carbonylamino]-3-(1-hydroxyethyl)phenyl]propanoic acid

Systemtic Name: 3-[2-[(4-carbamimidoylphenyl)carbonylamino]-3-(1-hydroxyethyl)phenyl]propanoic acid Openeye Name: 3-[2-[(4-carbamimidoylbenzoyl)amino]-3-(1-hydroxyethyl)phenyl]propanoic acid CAS Name: 3-[2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-3-(1-hydroxyethyl)phenyl]propanoic acid IUPAC Name: 3-[2-[(4-carbamimidoylbenzoyl)amino]-3-(1-hydroxyethyl)phenyl]propanoic acid Traditional Name: 3-[2-[(4-amidinobenzoyl)amino]-3-(1-hydroxyethyl)phenyl]propionic acid Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1NC(=O)C2=CC=C(C=C2)C(=N)N)CCC(=O)O)O

Isomeric SMILES

CC(C1=CC=CC(=C1NC(=O)C2=CC=C(C=C2)C(=N)N)CCC(=O)O)O

InChI

InChI=1S/C19H21N3O4/c1-11(23)15-4-2-3-12(9-10-16(24)25)17(15)22-19(26)14-7-5-13(6-8-14)18(20)21/h2-8,11,23H,9-10H2,1H3,(H3,20,21)(H,22,26)(H,24,25)