N-[4-(3-azanylisoquinolin-4-yl)phenyl]ethanamide

Systemtic Name: N-[4-(3-azanylisoquinolin-4-yl)phenyl]ethanamide Openeye Name: N-[4-(3-amino-4-isoquinolyl)phenyl]acetamide CAS Name: N-[4-(3-amino-4-isoquinolinyl)phenyl]acetamide IUPAC Name: N-[4-(3-aminoisoquinolin-4-yl)phenyl]acetamide Traditional Name: N-[4-(3-amino-4-isoquinolyl)phenyl]acetamide Formula: C17H15N3O MolecularWeight: 277.3205

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=C(N=CC3=CC=CC=C32)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=C(N=CC3=CC=CC=C32)N

InChI

InChI=1S/C17H15N3O/c1-11(21)20-14-8-6-12(7-9-14)16-15-5-3-2-4-13(15)10-19-17(16)18/h2-10H,1H3,(H2,18,19)(H,20,21)