2-[3,5-bis(hydroxymethyl)phenyl]-2-[(4-carbamimidoylphenyl)amino]ethanoic acid

Systemtic Name: 2-[3,5-bis(hydroxymethyl)phenyl]-2-[(4-carbamimidoylphenyl)amino]ethanoic acid Openeye Name: 2-[3,5-bis(hydroxymethyl)phenyl]-2-(4-carbamimidoylanilino)acetic acid CAS Name: 2-[3,5-bis(hydroxymethyl)phenyl]-2-(4-carbamimidoylanilino)acetic acid IUPAC Name: 2-[3,5-bis(hydroxymethyl)phenyl]-2-(4-carbamimidoylanilino)acetic acid Traditional Name: 2-(4-amidinoanilino)-2-(3,5-dimethylolphenyl)acetic acid Formula: C17H19N3O4 MolecularWeight: 329.35046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=N)N)NC(C2=CC(=CC(=C2)CO)CO)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=N)N)NC(C2=CC(=CC(=C2)CO)CO)C(=O)O

InChI

InChI=1S/C17H19N3O4/c18-16(19)12-1-3-14(4-2-12)20-15(17(23)24)13-6-10(8-21)5-11(7-13)9-22/h1-7,15,20-22H,8-9H2,(H3,18,19)(H,23,24)