tert-butyl 1-heptyl-3-methoxy-2-methyl-4-nitro-carbazole-9-carboxylate

Systemtic Name: tert-butyl 1-heptyl-3-methoxy-2-methyl-4-nitro-carbazole-9-carboxylate Openeye Name: tert-butyl 1-heptyl-3-methoxy-2-methyl-4-nitro-carbazole-9-carboxylate CAS Name: 1-heptyl-3-methoxy-2-methyl-4-nitro-9-carbazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-heptyl-3-methoxy-2-methyl-4-nitrocarbazole-9-carboxylate Traditional Name: 1-heptyl-3-methoxy-2-methyl-4-nitro-carbazole-9-carboxylic acid tert-butyl ester Formula: C26H34N2O5 MolecularWeight: 454.55856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C(=C(C2=C1N(C3=CC=CC=C32)C(=O)OC(C)(C)C)[N+](=O)[O-])OC)C

Isomeric SMILES

CCCCCCCC1=C(C(=C(C2=C1N(C3=CC=CC=C32)C(=O)OC(C)(C)C)[N+](=O)[O-])OC)C

InChI

InChI=1S/C26H34N2O5/c1-7-8-9-10-11-14-18-17(2)24(32-6)23(28(30)31)21-19-15-12-13-16-20(19)27(22(18)21)25(29)33-26(3,4)5/h12-13,15-16H,7-11,14H2,1-6H3