[3-bromanyl-5-chloranyl-2-(2-hydroxyethyloxy)phenyl] 2-[(4-carbamimidoylphenyl)amino]ethanoate

Systemtic Name: [3-bromanyl-5-chloranyl-2-(2-hydroxyethyloxy)phenyl] 2-[(4-carbamimidoylphenyl)amino]ethanoate Openeye Name: [3-bromo-5-chloro-2-(2-hydroxyethoxy)phenyl] 2-(4-carbamimidoylanilino)acetate CAS Name: 2-(4-carbamimidoylanilino)acetic acid [3-bromo-5-chloro-2-(2-hydroxyethoxy)phenyl] ester IUPAC Name: [3-bromo-5-chloro-2-(2-hydroxyethoxy)phenyl] 2-(4-carbamimidoylanilino)acetate Traditional Name: 2-(4-amidinoanilino)acetic acid [3-bromo-5-chloro-2-(2-hydroxyethoxy)phenyl] ester Formula: C17H17BrClN3O4 MolecularWeight: 442.69158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=N)N)NCC(=O)OC2=CC(=CC(=C2OCCO)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=N)N)NCC(=O)OC2=CC(=CC(=C2OCCO)Br)Cl

InChI

InChI=1S/C17H17BrClN3O4/c18-13-7-11(19)8-14(16(13)25-6-5-23)26-15(24)9-22-12-3-1-10(2-4-12)17(20)21/h1-4,7-8,22-23H,5-6,9H2,(H3,20,21)