ethyl 2-(decylamino)-4-nitro-benzoate

Systemtic Name: ethyl 2-(decylamino)-4-nitro-benzoate Openeye Name: ethyl 2-(decylamino)-4-nitro-benzoate CAS Name: 2-(decylamino)-4-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-(decylamino)-4-nitrobenzoate Traditional Name: 2-(decylamino)-4-nitro-benzoic acid ethyl ester Formula: C19H30N2O4 MolecularWeight: 350.4525

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCCCCCCCCCNC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C19H30N2O4/c1-3-5-6-7-8-9-10-11-14-20-18-15-16(21(23)24)12-13-17(18)19(22)25-4-2/h12-13,15,20H,3-11,14H2,1-2H3