2-[(4-carbamimidoylphenyl)amino]-2-[2-(2-hydroxyethyloxy)-5-propan-2-yl-phenyl]ethanoic acid

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-[2-(2-hydroxyethyloxy)-5-propan-2-yl-phenyl]ethanoic acid Openeye Name: 2-(4-carbamimidoylanilino)-2-[2-(2-hydroxyethoxy)-5-isopropyl-phenyl]acetic acid CAS Name: 2-(4-carbamimidoylanilino)-2-[2-(2-hydroxyethoxy)-5-propan-2-ylphenyl]acetic acid IUPAC Name: 2-(4-carbamimidoylanilino)-2-[2-(2-hydroxyethoxy)-5-propan-2-ylphenyl]acetic acid Traditional Name: 2-(4-amidinoanilino)-2-[2-(2-hydroxyethoxy)-5-isopropyl-phenyl]acetic acid Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)OCCO)C(C(=O)O)NC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OCCO)C(C(=O)O)NC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C20H25N3O4/c1-12(2)14-5-8-17(27-10-9-24)16(11-14)18(20(25)26)23-15-6-3-13(4-7-15)19(21)22/h3-8,11-12,18,23-24H,9-10H2,1-2H3,(H3,21,22)(H,25,26)