2-[(4-carbamimidoylphenyl)amino]-2-(3-phenylmethoxyphenyl)ethanoic acid

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-(3-phenylmethoxyphenyl)ethanoic acid Openeye Name: 2-(3-benzyloxyphenyl)-2-(4-carbamimidoylanilino)acetic acid CAS Name: 2-(4-carbamimidoylanilino)-2-(3-phenylmethoxyphenyl)acetic acid IUPAC Name: 2-(4-carbamimidoylanilino)-2-(3-phenylmethoxyphenyl)acetic acid Traditional Name: 2-(4-amidinoanilino)-2-(3-benzoxyphenyl)acetic acid Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(C(=O)O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(C(=O)O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H21N3O3/c23-21(24)16-9-11-18(12-10-16)25-20(22(26)27)17-7-4-8-19(13-17)28-14-15-5-2-1-3-6-15/h1-13,20,25H,14H2,(H3,23,24)(H,26,27)