N-[2-(1,3-benzodioxol-5-ylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-chloranyl-benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-chloranyl-benzamide Openeye Name: N-[2-(1,3-benzodioxole-5-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-chloro-benzamide CAS Name: N-[2-[1,3-benzodioxol-5-yl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-2-chlorobenzamide IUPAC Name: N-[2-(1,3-benzodioxole-5-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-chlorobenzamide Traditional Name: 2-chloro-N-(2-piperonyloyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Formula: C24H19ClN2O4 MolecularWeight: 434.87166

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)C3=CC=CC=C3Cl)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)C3=CC=CC=C3Cl)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H19ClN2O4/c25-20-4-2-1-3-19(20)23(28)26-18-7-5-15-9-10-27(13-17(15)11-18)24(29)16-6-8-21-22(12-16)31-14-30-21/h1-8,11-12H,9-10,13-14H2,(H,26,28)