[(4-carbamimidoylphenyl)amino] 2-[3-ethoxy-5-(2-methyl-1H-imidazol-5-yl)phenyl]ethanoate

Systemtic Name: [(4-carbamimidoylphenyl)amino] 2-[3-ethoxy-5-(2-methyl-1H-imidazol-5-yl)phenyl]ethanoate Openeye Name: (4-carbamimidoylanilino) 2-[3-ethoxy-5-(2-methyl-1H-imidazol-5-yl)phenyl]acetate CAS Name: 2-[3-ethoxy-5-(2-methyl-1H-imidazol-5-yl)phenyl]acetic acid (4-carbamimidoylanilino) ester IUPAC Name: (4-carbamimidoylanilino) 2-[3-ethoxy-5-(2-methyl-1H-imidazol-5-yl)phenyl]acetate Traditional Name: 2-[3-ethoxy-5-(2-methyl-1H-imidazol-5-yl)phenyl]acetic acid (4-amidinoanilino) ester Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)CC(=O)ONC2=CC=C(C=C2)C(=N)N)C3=CN=C(N3)C

Isomeric SMILES

CCOC1=CC(=CC(=C1)CC(=O)ONC2=CC=C(C=C2)C(=N)N)C3=CN=C(N3)C

InChI

InChI=1S/C21H23N5O3/c1-3-28-18-9-14(8-16(11-18)19-12-24-13(2)25-19)10-20(27)29-26-17-6-4-15(5-7-17)21(22)23/h4-9,11-12,26H,3,10H2,1-2H3,(H3,22,23)(H,24,25)