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

Systemtic Name: 2-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-phenyl]sulfonyl-2-nitro-phenyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-phenyl]sulfonyl-2-nitro-phenyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitrophenyl]sulfonyl-2-nitrophenyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitrophenyl]sulfonyl-2-nitrophenyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-phenyl]sulfonyl-2-nitro-phenyl]-3,4-dihydro-1H-isoquinoline Formula: C30H26N4O6S MolecularWeight: 570.61564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)S(=O)(=O)C4=CC(=C(C=C4)N5CCC6=CC=CC=C6C5)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)S(=O)(=O)C4=CC(=C(C=C4)N5CCC6=CC=CC=C6C5)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C30H26N4O6S/c35-33(36)29-17-25(9-11-27(29)31-15-13-21-5-1-3-7-23(21)19-31)41(39,40)26-10-12-28(30(18-26)34(37)38)32-16-14-22-6-2-4-8-24(22)20-32/h1-12,17-18H,13-16,19-20H2