N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(2-phenyl-1,3-oxazol-4-yl)ethanamide; ethanoic acid

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(2-phenyl-1,3-oxazol-4-yl)ethanamide; ethanoic acid Openeye Name: acetic acid; N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(2-phenyloxazol-4-yl)acetamide CAS Name: acetic acid; N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(2-phenyl-4-oxazolyl)acetamide IUPAC Name: acetic acid; N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(2-phenyl-1,3-oxazol-4-yl)acetamide Traditional Name: acetic acid; N-(4-amidinobenzyl)-2-ethoxy-2-(2-phenyloxazol-4-yl)acetamide Formula: C23H26N4O5 MolecularWeight: 438.47634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=COC(=N1)C2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)C(=N)N.CC(=O)O

Isomeric SMILES

CCOC(C1=COC(=N1)C2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)C(=N)N.CC(=O)O

InChI

InChI=1S/C21H22N4O3.C2H4O2/c1-2-27-18(17-13-28-21(25-17)16-6-4-3-5-7-16)20(26)24-12-14-8-10-15(11-9-14)19(22)23;1-2(3)4/h3-11,13,18H,2,12H2,1H3,(H3,22,23)(H,24,26);1H3,(H,3,4)