2-[(4-carbamimidoylphenyl)amino]-2-[3-(1-ethoxyethyl)-4-methoxy-phenyl]ethanoic acid

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-[3-(1-ethoxyethyl)-4-methoxy-phenyl]ethanoic acid Openeye Name: 2-(4-carbamimidoylanilino)-2-[3-(1-ethoxyethyl)-4-methoxy-phenyl]acetic acid CAS Name: 2-(4-carbamimidoylanilino)-2-[3-(1-ethoxyethyl)-4-methoxyphenyl]acetic acid IUPAC Name: 2-(4-carbamimidoylanilino)-2-[3-(1-ethoxyethyl)-4-methoxyphenyl]acetic acid Traditional Name: 2-(4-amidinoanilino)-2-[3-(1-ethoxyethyl)-4-methoxy-phenyl]acetic acid Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)C1=C(C=CC(=C1)C(C(=O)O)NC2=CC=C(C=C2)C(=N)N)OC

Isomeric SMILES

CCOC(C)C1=C(C=CC(=C1)C(C(=O)O)NC2=CC=C(C=C2)C(=N)N)OC

InChI

InChI=1S/C20H25N3O4/c1-4-27-12(2)16-11-14(7-10-17(16)26-3)18(20(24)25)23-15-8-5-13(6-9-15)19(21)22/h5-12,18,23H,4H2,1-3H3,(H3,21,22)(H,24,25)