ethyl 1-(4-methylphenyl)sulfonyl-2,6-bis(3-nitrophenyl)-2H-pyridine-3-carboxylate

Systemtic Name: ethyl 1-(4-methylphenyl)sulfonyl-2,6-bis(3-nitrophenyl)-2H-pyridine-3-carboxylate Openeye Name: ethyl 2,6-bis(3-nitrophenyl)-1-(p-tolylsulfonyl)-2H-pyridine-3-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-2,6-bis(3-nitrophenyl)-2H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylphenyl)sulfonyl-2,6-bis(3-nitrophenyl)-2H-pyridine-3-carboxylate Traditional Name: 2,6-bis(3-nitrophenyl)-1-tosyl-2H-pyridine-3-carboxylic acid ethyl ester Formula: C27H23N3O8S MolecularWeight: 549.55182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(N(C1C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(N(C1C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H23N3O8S/c1-3-38-27(31)24-14-15-25(19-6-4-8-21(16-19)29(32)33)28(39(36,37)23-12-10-18(2)11-13-23)26(24)20-7-5-9-22(17-20)30(34)35/h4-17,26H,3H2,1-2H3