N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(6-methyl-3-oxidanylidene-1H-isoindol-2-yl)ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(6-methyl-3-oxidanylidene-1H-isoindol-2-yl)ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(5-methyl-1-oxo-isoindolin-2-yl)acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(6-methyl-3-oxo-1H-isoindol-2-yl)acetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(6-methyl-3-oxo-1H-isoindol-2-yl)acetamide Traditional Name: N-(4-amidinobenzyl)-2-ethoxy-2-(1-keto-5-methyl-isoindolin-2-yl)acetamide Formula: C21H24N4O3 MolecularWeight: 380.44026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=O)NCC1=CC=C(C=C1)C(=N)N)N2CC3=C(C2=O)C=CC(=C3)C

Isomeric SMILES

CCOC(C(=O)NCC1=CC=C(C=C1)C(=N)N)N2CC3=C(C2=O)C=CC(=C3)C

InChI

InChI=1S/C21H24N4O3/c1-3-28-21(25-12-16-10-13(2)4-9-17(16)20(25)27)19(26)24-11-14-5-7-15(8-6-14)18(22)23/h4-10,21H,3,11-12H2,1-2H3,(H3,22,23)(H,24,26)