2-[methyl(tetradecyl)amino]-5-nitro-benzoic acid

Systemtic Name: 2-[methyl(tetradecyl)amino]-5-nitro-benzoic acid Openeye Name: 2-[methyl(tetradecyl)amino]-5-nitro-benzoic acid CAS Name: 2-[methyl(tetradecyl)amino]-5-nitrobenzoic acid IUPAC Name: 2-[methyl(tetradecyl)amino]-5-nitrobenzoic acid Traditional Name: 2-[methyl(myristyl)amino]-5-nitro-benzoic acid Formula: C22H36N2O4 MolecularWeight: 392.53224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C22H36N2O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-23(2)21-16-15-19(24(27)28)18-20(21)22(25)26/h15-16,18H,3-14,17H2,1-2H3,(H,25,26)