methyl 3-(2-nitro-4-piperidin-1-ylsulfonyl-phenoxy)naphthalene-2-carboxylate

Systemtic Name: methyl 3-(2-nitro-4-piperidin-1-ylsulfonyl-phenoxy)naphthalene-2-carboxylate Openeye Name: methyl 3-[2-nitro-4-(1-piperidylsulfonyl)phenoxy]naphthalene-2-carboxylate CAS Name: 3-[2-nitro-4-(1-piperidinylsulfonyl)phenoxy]-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 3-(2-nitro-4-piperidin-1-ylsulfonylphenoxy)naphthalene-2-carboxylate Traditional Name: 3-(2-nitro-4-piperidinosulfonyl-phenoxy)naphthalene-2-carboxylic acid methyl ester Formula: C23H22N2O7S MolecularWeight: 470.49498

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=CC=CC=C2C=C1OC3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC2=CC=CC=C2C=C1OC3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H22N2O7S/c1-31-23(26)19-13-16-7-3-4-8-17(16)14-22(19)32-21-10-9-18(15-20(21)25(27)28)33(29,30)24-11-5-2-6-12-24/h3-4,7-10,13-15H,2,5-6,11-12H2,1H3