(4-cyanophenyl)methyl N-isoquinolin-5-ylcarbamate

Systemtic Name: (4-cyanophenyl)methyl N-isoquinolin-5-ylcarbamate Openeye Name: (4-cyanophenyl)methyl N-(5-isoquinolyl)carbamate CAS Name: N-(5-isoquinolinyl)carbamic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl N-isoquinolin-5-ylcarbamate Traditional Name: N-(5-isoquinolyl)carbamic acid (4-cyanobenzyl) ester Formula: C18H13N3O2 MolecularWeight: 303.31472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H13N3O2/c19-10-13-4-6-14(7-5-13)12-23-18(22)21-17-3-1-2-15-11-20-9-8-16(15)17/h1-9,11H,12H2,(H,21,22)