tert-butyl 2-[[3-(chloromethyl)-6-nitro-2,3-dihydroindol-1-yl]sulfonyl]-5-methoxy-indole-1-carboxylate

Systemtic Name: tert-butyl 2-[[3-(chloromethyl)-6-nitro-2,3-dihydroindol-1-yl]sulfonyl]-5-methoxy-indole-1-carboxylate Openeye Name: tert-butyl 2-[3-(chloromethyl)-6-nitro-indolin-1-yl]sulfonyl-5-methoxy-indole-1-carboxylate CAS Name: 2-[[3-(chloromethyl)-6-nitro-2,3-dihydroindol-1-yl]sulfonyl]-5-methoxy-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[3-(chloromethyl)-6-nitro-2,3-dihydroindol-1-yl]sulfonyl]-5-methoxyindole-1-carboxylate Traditional Name: 2-[3-(chloromethyl)-6-nitro-indolin-1-yl]sulfonyl-5-methoxy-indole-1-carboxylic acid tert-butyl ester Formula: C23H24ClN3O7S MolecularWeight: 521.97056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)OC)C=C1S(=O)(=O)N3CC(C4=C3C=C(C=C4)[N+](=O)[O-])CCl

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)OC)C=C1S(=O)(=O)N3CC(C4=C3C=C(C=C4)[N+](=O)[O-])CCl

InChI

InChI=1S/C23H24ClN3O7S/c1-23(2,3)34-22(28)26-19-8-6-17(33-4)9-14(19)10-21(26)35(31,32)25-13-15(12-24)18-7-5-16(27(29)30)11-20(18)25/h5-11,15H,12-13H2,1-4H3