methyl 2-[(8-azanylisoquinolin-5-yl)amino]ethanoate

Systemtic Name: methyl 2-[(8-azanylisoquinolin-5-yl)amino]ethanoate Openeye Name: methyl 2-[(8-amino-5-isoquinolyl)amino]acetate CAS Name: 2-[(8-amino-5-isoquinolinyl)amino]acetic acid methyl ester IUPAC Name: methyl 2-[(8-aminoisoquinolin-5-yl)amino]acetate Traditional Name: 2-[(8-amino-5-isoquinolyl)amino]acetic acid methyl ester Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC1=C2C=CN=CC2=C(C=C1)N

Isomeric SMILES

COC(=O)CNC1=C2C=CN=CC2=C(C=C1)N

InChI

InChI=1S/C12H13N3O2/c1-17-12(16)7-15-11-3-2-10(13)9-6-14-5-4-8(9)11/h2-6,15H,7,13H2,1H3