methyl 2-[3-[(4-methylphenyl)methylsulfamoyl]-5-nitro-indol-1-yl]ethanoate

Systemtic Name: methyl 2-[3-[(4-methylphenyl)methylsulfamoyl]-5-nitro-indol-1-yl]ethanoate Openeye Name: methyl 2-[5-nitro-3-(p-tolylmethylsulfamoyl)indol-1-yl]acetate CAS Name: 2-[3-[(4-methylphenyl)methylsulfamoyl]-5-nitro-1-indolyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[(4-methylphenyl)methylsulfamoyl]-5-nitroindol-1-yl]acetate Traditional Name: 2-[3-[(4-methylbenzyl)sulfamoyl]-5-nitro-indol-1-yl]acetic acid methyl ester Formula: C19H19N3O6S MolecularWeight: 417.43566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNS(=O)(=O)C2=CN(C3=C2C=C(C=C3)[N+](=O)[O-])CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)CNS(=O)(=O)C2=CN(C3=C2C=C(C=C3)[N+](=O)[O-])CC(=O)OC

InChI

InChI=1S/C19H19N3O6S/c1-13-3-5-14(6-4-13)10-20-29(26,27)18-11-21(12-19(23)28-2)17-8-7-15(22(24)25)9-16(17)18/h3-9,11,20H,10,12H2,1-2H3