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

Systemtic Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-nitro-phenyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-nitro-phenyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-nitrophenyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-nitrophenyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-nitro-phenyl]-3,4-dihydro-1H-isoquinoline Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4)[N+](=O)[O-]

InChI

InChI=1S/C24H23N3O4S/c28-27(29)24-15-22(32(30,31)26-14-12-19-6-2-4-8-21(19)17-26)9-10-23(24)25-13-11-18-5-1-3-7-20(18)16-25/h1-10,15H,11-14,16-17H2