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

Systemtic Name: (4-methyl-3,5-dinitro-phenyl)-(1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (4-methyl-3,5-dinitro-phenyl)-(1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: (4-methyl-3,5-dinitrophenyl)-(1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: (4-methyl-3,5-dinitrophenyl)-(1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (4-methyl-3,5-dinitro-phenyl)-(1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C23H19N3O5 MolecularWeight: 417.41406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)N2CCC3=CC=CC=C3C2C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)N2CCC3=CC=CC=C3C2C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H19N3O5/c1-15-20(25(28)29)13-18(14-21(15)26(30)31)23(27)24-12-11-16-7-5-6-10-19(16)22(24)17-8-3-2-4-9-17/h2-10,13-14,22H,11-12H2,1H3