(3-nitrophenyl)methyl 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate

Systemtic Name: (3-nitrophenyl)methyl 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate Openeye Name: (3-nitrophenyl)methyl 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate CAS Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate Traditional Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoic acid (3-nitrobenzyl) ester Formula: C23H20N2O6S MolecularWeight: 452.4797

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=CC(=C3)C(=O)OCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=CC(=C3)C(=O)OCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H20N2O6S/c26-23(31-16-17-6-3-10-20(14-17)25(27)28)19-8-4-11-21(15-19)32(29,30)24-13-5-9-18-7-1-2-12-22(18)24/h1-4,6-8,10-12,14-15H,5,9,13,16H2