N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(7-methyl-3-oxidanylidene-1H-isoindol-2-yl)ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(7-methyl-3-oxidanylidene-1H-isoindol-2-yl)ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(4-methyl-1-oxo-isoindolin-2-yl)acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(7-methyl-3-oxo-1H-isoindol-2-yl)acetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(7-methyl-3-oxo-1H-isoindol-2-yl)acetamide Traditional Name: N-(4-amidinobenzyl)-2-ethoxy-2-(1-keto-4-methyl-isoindolin-2-yl)acetamide Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=O)NCC1=CC=C(C=C1)C(=N)N)N2CC3=C(C2=O)C=CC=C3C

Isomeric SMILES

CCOC(C(=O)NCC1=CC=C(C=C1)C(=N)N)N2CC3=C(C2=O)C=CC=C3C

InChI

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