propan-2-yl 1-(4-nitrophenyl)sulfonylcycloheptane-1-carboxylate

Systemtic Name: propan-2-yl 1-(4-nitrophenyl)sulfonylcycloheptane-1-carboxylate Openeye Name: isopropyl 1-(4-nitrophenyl)sulfonylcycloheptanecarboxylate CAS Name: 1-(4-nitrophenyl)sulfonyl-1-cycloheptanecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-(4-nitrophenyl)sulfonylcycloheptane-1-carboxylate Traditional Name: 1-nosylcycloheptanecarboxylic acid isopropyl ester Formula: C17H23NO6S MolecularWeight: 369.43262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1(CCCCCC1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)C1(CCCCCC1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H23NO6S/c1-13(2)24-16(19)17(11-5-3-4-6-12-17)25(22,23)15-9-7-14(8-10-15)18(20)21/h7-10,13H,3-6,11-12H2,1-2H3