3-azanyl-2-(3-imidazol-1-ylpropyl)isoquinolin-1-one

Systemtic Name: 3-azanyl-2-(3-imidazol-1-ylpropyl)isoquinolin-1-one Openeye Name: 3-amino-2-(3-imidazol-1-ylpropyl)isoquinolin-1-one CAS Name: 3-amino-2-[3-(1-imidazolyl)propyl]-1-isoquinolinone IUPAC Name: 3-amino-2-(3-imidazol-1-ylpropyl)isoquinolin-1-one Traditional Name: 3-amino-2-(3-imidazol-1-ylpropyl)isocarbostyril Formula: C15H16N4O MolecularWeight: 268.31374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N(C2=O)CCCN3C=CN=C3)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N(C2=O)CCCN3C=CN=C3)N

InChI

InChI=1S/C15H16N4O/c16-14-10-12-4-1-2-5-13(12)15(20)19(14)8-3-7-18-9-6-17-11-18/h1-2,4-6,9-11H,3,7-8,16H2