2-[(4-carbamimidoylphenyl)amino]-2-(2-cyclopentyloxy-5-ethyl-phenyl)ethanoic acid

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-(2-cyclopentyloxy-5-ethyl-phenyl)ethanoic acid Openeye Name: 2-(4-carbamimidoylanilino)-2-[2-(cyclopentoxy)-5-ethyl-phenyl]acetic acid CAS Name: 2-(4-carbamimidoylanilino)-2-(2-cyclopentyloxy-5-ethylphenyl)acetic acid IUPAC Name: 2-(4-carbamimidoylanilino)-2-(2-cyclopentyloxy-5-ethylphenyl)acetic acid Traditional Name: 2-(4-amidinoanilino)-2-[2-(cyclopentoxy)-5-ethyl-phenyl]acetic acid Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OC2CCCC2)C(C(=O)O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCC1=CC(=C(C=C1)OC2CCCC2)C(C(=O)O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H27N3O3/c1-2-14-7-12-19(28-17-5-3-4-6-17)18(13-14)20(22(26)27)25-16-10-8-15(9-11-16)21(23)24/h7-13,17,20,25H,2-6H2,1H3,(H3,23,24)(H,26,27)