2-[(3,4-dichlorophenyl)methylsulfonyl]-7-nitro-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfonyl]-7-nitro-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfonyl]-7-nitro-3,4-dihydro-1H-isoquinoline CAS Name: 2-[(3,4-dichlorophenyl)methylsulfonyl]-7-nitro-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfonyl]-7-nitro-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(3,4-dichlorobenzyl)sulfonyl-7-nitro-3,4-dihydro-1H-isoquinoline Formula: C16H14Cl2N2O4S MolecularWeight: 401.26436

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)[N+](=O)[O-])S(=O)(=O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)[N+](=O)[O-])S(=O)(=O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H14Cl2N2O4S/c17-15-4-1-11(7-16(15)18)10-25(23,24)19-6-5-12-2-3-14(20(21)22)8-13(12)9-19/h1-4,7-8H,5-6,9-10H2