methyl 1-(4-methylphenyl)sulfonyl-3-[(E)-2-nitroethenyl]indole-4-carboxylate

Systemtic Name: methyl 1-(4-methylphenyl)sulfonyl-3-[(E)-2-nitroethenyl]indole-4-carboxylate Openeye Name: methyl 3-[(E)-2-nitrovinyl]-1-(p-tolylsulfonyl)indole-4-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-3-[(E)-2-nitroethenyl]-4-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-methylphenyl)sulfonyl-3-[(E)-2-nitroethenyl]indole-4-carboxylate Traditional Name: 3-[(E)-2-nitrovinyl]-1-tosyl-indole-4-carboxylic acid methyl ester Formula: C19H16N2O6S MolecularWeight: 400.40514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C(C=CC=C32)C(=O)OC)C=C[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C(C=CC=C32)C(=O)OC)/C=C/[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O6S/c1-13-6-8-15(9-7-13)28(25,26)20-12-14(10-11-21(23)24)18-16(19(22)27-2)4-3-5-17(18)20/h3-12H,1-2H3/b11-10+