6-(3-azanylpropyl)-4-bromanyl-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one

Systemtic Name: 6-(3-azanylpropyl)-4-bromanyl-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one Openeye Name: 6-(3-aminopropyl)-4-bromo-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one CAS Name: 6-(3-aminopropyl)-4-bromo-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one IUPAC Name: 6-(3-aminopropyl)-4-bromo-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one Traditional Name: 6-(3-aminopropyl)-4-bromo-9-(1H-pyrazol-4-yl)-2H-benz[h]isoquinolin-1-one Formula: C19H17BrN4O MolecularWeight: 397.26848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C3C(=CNC(=O)C3=C2C=C1C4=CNN=C4)Br)CCCN

Isomeric SMILES

C1=CC2=C(C=C3C(=CNC(=O)C3=C2C=C1C4=CNN=C4)Br)CCCN

InChI

InChI=1S/C19H17BrN4O/c20-17-10-22-19(25)18-15-6-11(13-8-23-24-9-13)3-4-14(15)12(2-1-5-21)7-16(17)18/h3-4,6-10H,1-2,5,21H2,(H,22,25)(H,23,24)