N-[4-(4-aminophenyl)isoquinolin-3-yl]ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=CC=CC=C2C=N1)C3=CC=C(C=C3)N

Isomeric SMILES

CC(=O)NC1=C(C2=CC=CC=C2C=N1)C3=CC=C(C=C3)N

InChI

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