1-[(1-azanyl-6-methoxy-isoquinolin-7-yl)methyl]-2-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-[(1-azanyl-6-methoxy-isoquinolin-7-yl)methyl]-2-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-[(1-amino-6-methoxy-7-isoquinolyl)methyl]-2-oxo-pyrrolidine-3-carboxamide CAS Name: 1-[(1-amino-6-methoxy-7-isoquinolinyl)methyl]-2-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-[(1-amino-6-methoxyisoquinolin-7-yl)methyl]-2-oxopyrrolidine-3-carboxamide Traditional Name: 1-[(1-amino-6-methoxy-7-isoquinolyl)methyl]-2-keto-pyrrolidine-3-carboxamide Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=CN=C2N)CN3CCC(C3=O)C(=O)N

Isomeric SMILES

COC1=C(C=C2C(=C1)C=CN=C2N)CN3CCC(C3=O)C(=O)N

InChI

InChI=1S/C16H18N4O3/c1-23-13-7-9-2-4-19-14(17)12(9)6-10(13)8-20-5-3-11(15(18)21)16(20)22/h2,4,6-7,11H,3,5,8H2,1H3,(H2,17,19)(H2,18,21)