N1-[2-(1-azanylisoquinolin-7-yl)oxyethyl]-N4,N4-dimethyl-benzene-1,4-dicarboxamide

Systemtic Name: N1-[2-(1-azanylisoquinolin-7-yl)oxyethyl]-N4,N4-dimethyl-benzene-1,4-dicarboxamide Openeye Name: N1-[2-[(1-amino-7-isoquinolyl)oxy]ethyl]-N4,N4-dimethyl-terephthalamide CAS Name: N1-[2-[(1-amino-7-isoquinolinyl)oxy]ethyl]-N4,N4-dimethylbenzene-1,4-dicarboxamide IUPAC Name: 1-N-[2-(1-aminoisoquinolin-7-yl)oxyethyl]-4-N,4-N-dimethylbenzene-1,4-dicarboxamide Traditional Name: N-[2-[(1-amino-7-isoquinolyl)oxy]ethyl]-N',N'-dimethyl-terephthalamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O3/c1-25(2)21(27)16-5-3-15(4-6-16)20(26)24-11-12-28-17-8-7-14-9-10-23-19(22)18(14)13-17/h3-10,13H,11-12H2,1-2H3,(H2,22,23)(H,24,26)