ethyl 3-dodecanoyl-1-methyl-5-nitro-indole-2-carboxylate

Systemtic Name: ethyl 3-dodecanoyl-1-methyl-5-nitro-indole-2-carboxylate Openeye Name: ethyl 3-dodecanoyl-1-methyl-5-nitro-indole-2-carboxylate CAS Name: 1-methyl-5-nitro-3-(1-oxododecyl)-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-dodecanoyl-1-methyl-5-nitroindole-2-carboxylate Traditional Name: 3-lauroyl-1-methyl-5-nitro-indole-2-carboxylic acid ethyl ester Formula: C24H34N2O5 MolecularWeight: 430.53716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=C(N(C2=C1C=C(C=C2)[N+](=O)[O-])C)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=C(N(C2=C1C=C(C=C2)[N+](=O)[O-])C)C(=O)OCC

InChI

InChI=1S/C24H34N2O5/c1-4-6-7-8-9-10-11-12-13-14-21(27)22-19-17-18(26(29)30)15-16-20(19)25(3)23(22)24(28)31-5-2/h15-17H,4-14H2,1-3H3