2-(2-chloranyl-4-nitro-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-(2-chloranyl-4-nitro-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(2-chloro-4-nitro-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-(2-chloro-4-nitrophenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-(2-chloro-4-nitrophenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(2-chloro-4-nitro-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C17H15ClN2O4 MolecularWeight: 346.765

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H15ClN2O4/c18-15-9-14(20(22)23)5-6-16(15)24-11-17(21)19-8-7-12-3-1-2-4-13(12)10-19/h1-6,9H,7-8,10-11H2