methyl 4-(dodecylamino)-3-nitro-benzoate

Systemtic Name: methyl 4-(dodecylamino)-3-nitro-benzoate Openeye Name: methyl 4-(dodecylamino)-3-nitro-benzoate CAS Name: 4-(dodecylamino)-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-(dodecylamino)-3-nitrobenzoate Traditional Name: 4-(laurylamino)-3-nitro-benzoic acid methyl ester Formula: C20H32N2O4 MolecularWeight: 364.47908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCNC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H32N2O4/c1-3-4-5-6-7-8-9-10-11-12-15-21-18-14-13-17(20(23)26-2)16-19(18)22(24)25/h13-14,16,21H,3-12,15H2,1-2H3