9-[4-(aminomethyl)phenyl]-6-(3-azanylpropyl)-2H-benzo[h]isoquinolin-1-one

Systemtic Name: 9-[4-(aminomethyl)phenyl]-6-(3-azanylpropyl)-2H-benzo[h]isoquinolin-1-one Openeye Name: 9-[4-(aminomethyl)phenyl]-6-(3-aminopropyl)-2H-benzo[h]isoquinolin-1-one CAS Name: 9-[4-(aminomethyl)phenyl]-6-(3-aminopropyl)-2H-benzo[h]isoquinolin-1-one IUPAC Name: 9-[4-(aminomethyl)phenyl]-6-(3-aminopropyl)-2H-benzo[h]isoquinolin-1-one Traditional Name: 9-[4-(aminomethyl)phenyl]-6-(3-aminopropyl)-2H-benz[h]isoquinolin-1-one Formula: C23H23N3O MolecularWeight: 357.44822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN)C2=CC3=C4C(=CC(=C3C=C2)CCCN)C=CNC4=O

Isomeric SMILES

C1=CC(=CC=C1CN)C2=CC3=C4C(=CC(=C3C=C2)CCCN)C=CNC4=O

InChI

InChI=1S/C23H23N3O/c24-10-1-2-18-12-19-9-11-26-23(27)22(19)21-13-17(7-8-20(18)21)16-5-3-15(14-25)4-6-16/h3-9,11-13H,1-2,10,14,24-25H2,(H,26,27)