N-isoquinolin-6-yl-2-[(phenylmethyl)amino]ethanamide

Systemtic Name: N-isoquinolin-6-yl-2-[(phenylmethyl)amino]ethanamide Openeye Name: 2-(benzylamino)-N-(6-isoquinolyl)acetamide CAS Name: N-(6-isoquinolinyl)-2-[(phenylmethyl)amino]acetamide IUPAC Name: 2-(benzylamino)-N-isoquinolin-6-ylacetamide Traditional Name: 2-(benzylamino)-N-(6-isoquinolyl)acetamide Formula: C18H17N3O MolecularWeight: 291.34708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCC(=O)NC2=CC3=C(C=C2)C=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNCC(=O)NC2=CC3=C(C=C2)C=NC=C3

InChI

InChI=1S/C18H17N3O/c22-18(13-20-11-14-4-2-1-3-5-14)21-17-7-6-16-12-19-9-8-15(16)10-17/h1-10,12,20H,11,13H2,(H,21,22)