8-azanyl-2-(1,3-benzodioxol-5-ylmethyl)-5-bromanyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 8-azanyl-2-(1,3-benzodioxol-5-ylmethyl)-5-bromanyl-3,4-dihydroisoquinolin-1-one Openeye Name: 8-amino-2-(1,3-benzodioxol-5-ylmethyl)-5-bromo-3,4-dihydroisoquinolin-1-one CAS Name: 8-amino-2-(1,3-benzodioxol-5-ylmethyl)-5-bromo-3,4-dihydroisoquinolin-1-one IUPAC Name: 8-amino-2-(1,3-benzodioxol-5-ylmethyl)-5-bromo-3,4-dihydroisoquinolin-1-one Traditional Name: 8-amino-5-bromo-2-piperonyl-3,4-dihydroisocarbostyril Formula: C17H15BrN2O3 MolecularWeight: 375.2166

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C(C=CC(=C21)Br)N)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(C(=O)C2=C(C=CC(=C21)Br)N)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H15BrN2O3/c18-12-2-3-13(19)16-11(12)5-6-20(17(16)21)8-10-1-4-14-15(7-10)23-9-22-14/h1-4,7H,5-6,8-9,19H2