N-[2-(1-azanylisoquinolin-7-yl)oxyethyl]-4-(N,N-dimethylcarbamimidoyl)benzamide

Systemtic Name: N-[2-(1-azanylisoquinolin-7-yl)oxyethyl]-4-(N,N-dimethylcarbamimidoyl)benzamide Openeye Name: N-[2-[(1-amino-7-isoquinolyl)oxy]ethyl]-4-(N,N-dimethylcarbamimidoyl)benzamide CAS Name: N-[2-[(1-amino-7-isoquinolinyl)oxy]ethyl]-4-[dimethylamino(imino)methyl]benzamide IUPAC Name: N-[2-(1-aminoisoquinolin-7-yl)oxyethyl]-4-(N,N-dimethylcarbamimidoyl)benzamide Traditional Name: N-[2-[(1-amino-7-isoquinolyl)oxy]ethyl]-4-(N,N-dimethylamidino)benzamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=N)C1=CC=C(C=C1)C(=O)NCCOC2=CC3=C(C=C2)C=CN=C3N

Isomeric SMILES

CN(C)C(=N)C1=CC=C(C=C1)C(=O)NCCOC2=CC3=C(C=C2)C=CN=C3N

InChI

InChI=1S/C21H23N5O2/c1-26(2)20(23)15-3-5-16(6-4-15)21(27)25-11-12-28-17-8-7-14-9-10-24-19(22)18(14)13-17/h3-10,13,23H,11-12H2,1-2H3,(H2,22,24)(H,25,27)