4-[(isoquinolin-5-ylamino)methyl]benzamide

Systemtic Name: 4-[(isoquinolin-5-ylamino)methyl]benzamide Openeye Name: 4-[(5-isoquinolylamino)methyl]benzamide CAS Name: 4-[(5-isoquinolinylamino)methyl]benzamide IUPAC Name: 4-[(isoquinolin-5-ylamino)methyl]benzamide Traditional Name: 4-[(5-isoquinolylamino)methyl]benzamide Formula: C17H15N3O MolecularWeight: 277.3205

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)NCC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)NCC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C17H15N3O/c18-17(21)13-6-4-12(5-7-13)10-20-16-3-1-2-14-11-19-9-8-15(14)16/h1-9,11,20H,10H2,(H2,18,21)