(4-carbamimidoyl-2-methoxy-phenyl) 3-methylbutanoate

Systemtic Name: (4-carbamimidoyl-2-methoxy-phenyl) 3-methylbutanoate Openeye Name: (4-carbamimidoyl-2-methoxy-phenyl) 3-methylbutanoate CAS Name: 3-methylbutanoic acid (4-carbamimidoyl-2-methoxyphenyl) ester IUPAC Name: (4-carbamimidoyl-2-methoxyphenyl) 3-methylbutanoate Traditional Name: 3-methylbutyric acid (4-amidino-2-methoxy-phenyl) ester Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OC1=C(C=C(C=C1)C(=N)N)OC

Isomeric SMILES

CC(C)CC(=O)OC1=C(C=C(C=C1)C(=N)N)OC

InChI

InChI=1S/C13H18N2O3/c1-8(2)6-12(16)18-10-5-4-9(13(14)15)7-11(10)17-3/h4-5,7-8H,6H2,1-3H3,(H3,14,15)