3,4-dihydro-1H-isoquinolin-2-yl-(2-methyl-3,5-dinitro-phenyl)methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2-methyl-3,5-dinitro-phenyl)methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2-methyl-3,5-dinitro-phenyl)methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2-methyl-3,5-dinitrophenyl)methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2-methyl-3,5-dinitrophenyl)methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2-methyl-3,5-dinitro-phenyl)methanone Formula: C17H15N3O5 MolecularWeight: 341.3181

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)N2CCC3=CC=CC=C3C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)N2CCC3=CC=CC=C3C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O5/c1-11-15(8-14(19(22)23)9-16(11)20(24)25)17(21)18-7-6-12-4-2-3-5-13(12)10-18/h2-5,8-9H,6-7,10H2,1H3