4-azanyl-N-[(E)-isoquinolin-3-ylmethylideneamino]benzamide

Systemtic Name: 4-azanyl-N-[(E)-isoquinolin-3-ylmethylideneamino]benzamide Openeye Name: 4-amino-N-[(E)-3-isoquinolylmethyleneamino]benzamide CAS Name: 4-amino-N-[(E)-3-isoquinolinylmethylideneamino]benzamide IUPAC Name: 4-amino-N-[(E)-isoquinolin-3-ylmethylideneamino]benzamide Traditional Name: 4-amino-N-[(E)-3-isoquinolylmethyleneamino]benzamide Formula: C17H14N4O MolecularWeight: 290.31926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)C=NNC(=O)C3=CC=C(C=C3)N

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)/C=N/NC(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C17H14N4O/c18-15-7-5-12(6-8-15)17(22)21-20-11-16-9-13-3-1-2-4-14(13)10-19-16/h1-11H,18H2,(H,21,22)/b20-11+