N-[5-[(3-acetamido-4-isocyanato-phenyl)methyl]-2-isocyanato-phenyl]ethanamide

Systemtic Name: N-[5-[(3-acetamido-4-isocyanato-phenyl)methyl]-2-isocyanato-phenyl]ethanamide Openeye Name: N-[5-[(3-acetamido-4-isocyanato-phenyl)methyl]-2-isocyanato-phenyl]acetamide CAS Name: N-[5-[(3-acetamido-4-isocyanatophenyl)methyl]-2-isocyanatophenyl]acetamide IUPAC Name: N-[5-[(3-acetamido-4-isocyanatophenyl)methyl]-2-isocyanatophenyl]acetamide Traditional Name: N-[5-(3-acetamido-4-isocyanato-benzyl)-2-isocyanato-phenyl]acetamide Formula: C19H16N4O4 MolecularWeight: 364.35474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N=C=O)NC(=O)C)N=C=O

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N=C=O)NC(=O)C)N=C=O

InChI

InChI=1S/C19H16N4O4/c1-12(26)22-18-8-14(3-5-16(18)20-10-24)7-15-4-6-17(21-11-25)19(9-15)23-13(2)27/h3-6,8-9H,7H2,1-2H3,(H,22,26)(H,23,27)