[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-phenyl]-(4-nitrophenyl)methanone

Systemtic Name: [4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-phenyl]-(4-nitrophenyl)methanone Openeye Name: [4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-phenyl]-(4-nitrophenyl)methanone CAS Name: [4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitrophenyl]-(4-nitrophenyl)methanone IUPAC Name: [4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitrophenyl]-(4-nitrophenyl)methanone Traditional Name: [4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-phenyl]-(4-nitrophenyl)methanone Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O5/c26-22(16-5-8-19(9-6-16)24(27)28)17-7-10-20(21(13-17)25(29)30)23-12-11-15-3-1-2-4-18(15)14-23/h1-10,13H,11-12,14H2