1H-1,4-benzodiazepin-2-yl(isoquinolin-1-yl)methanone

Systemtic Name: 1H-1,4-benzodiazepin-2-yl(isoquinolin-1-yl)methanone Openeye Name: 1H-1,4-benzodiazepin-2-yl(1-isoquinolyl)methanone CAS Name: 1H-1,4-benzodiazepin-2-yl(1-isoquinolinyl)methanone IUPAC Name: 1H-1,4-benzodiazepin-2-yl(isoquinolin-1-yl)methanone Traditional Name: 1H-1,4-benzodiazepin-2-yl(1-isoquinolyl)methanone Formula: C19H13N3O MolecularWeight: 299.32602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2C(=O)C3=CN=CC4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2C(=O)C3=CN=CC4=CC=CC=C4N3

InChI

InChI=1S/C19H13N3O/c23-19(18-15-7-3-1-5-13(15)9-10-21-18)17-12-20-11-14-6-2-4-8-16(14)22-17/h1-12,22H