ethyl 3-(6-nitro-1,3-benzodioxol-5-yl)-9-(phenylsulfonyl)carbazole-2-carboxylate

Systemtic Name: ethyl 3-(6-nitro-1,3-benzodioxol-5-yl)-9-(phenylsulfonyl)carbazole-2-carboxylate Openeye Name: ethyl 9-(benzenesulfonyl)-3-(6-nitro-1,3-benzodioxol-5-yl)carbazole-2-carboxylate CAS Name: 9-(benzenesulfonyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-carbazolecarboxylic acid ethyl ester IUPAC Name: ethyl 9-(benzenesulfonyl)-3-(6-nitro-1,3-benzodioxol-5-yl)carbazole-2-carboxylate Traditional Name: 9-besyl-3-(6-nitro-1,3-benzodioxol-5-yl)carbazole-2-carboxylic acid ethyl ester Formula: C28H20N2O8S MolecularWeight: 544.532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C2C3=CC=CC=C3N(C2=C1)S(=O)(=O)C4=CC=CC=C4)C5=CC6=C(C=C5[N+](=O)[O-])OCO6

Isomeric SMILES

CCOC(=O)C1=C(C=C2C3=CC=CC=C3N(C2=C1)S(=O)(=O)C4=CC=CC=C4)C5=CC6=C(C=C5[N+](=O)[O-])OCO6

InChI

InChI=1S/C28H20N2O8S/c1-2-36-28(31)22-13-24-20(12-19(22)21-14-26-27(38-16-37-26)15-25(21)30(32)33)18-10-6-7-11-23(18)29(24)39(34,35)17-8-4-3-5-9-17/h3-15H,2,16H2,1H3