2-(4-ethylsulfonyl-6-nitro-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propan-1-ol

Systemtic Name: 2-(4-ethylsulfonyl-6-nitro-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propan-1-ol Openeye Name: 2-(4-ethylsulfonyl-6-nitro-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propan-1-ol CAS Name: 2-(4-ethylsulfonyl-6-nitro-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-1-propanol IUPAC Name: 2-(4-ethylsulfonyl-6-nitro-1,2,3,4-tetrahydroquinolin-2-yl)-2-methylpropan-1-ol Traditional Name: 2-(4-esyl-6-nitro-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propan-1-ol Formula: C15H22N2O5S MolecularWeight: 342.41058

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1CC(NC2=C1C=C(C=C2)[N+](=O)[O-])C(C)(C)CO

Isomeric SMILES

CCS(=O)(=O)C1CC(NC2=C1C=C(C=C2)[N+](=O)[O-])C(C)(C)CO

InChI

InChI=1S/C15H22N2O5S/c1-4-23(21,22)13-8-14(15(2,3)9-18)16-12-6-5-10(17(19)20)7-11(12)13/h5-7,13-14,16,18H,4,8-9H2,1-3H3