2-(dibutylamino)ethyl 2,6-dimethyl-3-nitro-benzoate

Systemtic Name: 2-(dibutylamino)ethyl 2,6-dimethyl-3-nitro-benzoate Openeye Name: 2-(dibutylamino)ethyl 2,6-dimethyl-3-nitro-benzoate CAS Name: 2,6-dimethyl-3-nitrobenzoic acid 2-(dibutylamino)ethyl ester IUPAC Name: 2-(dibutylamino)ethyl 2,6-dimethyl-3-nitrobenzoate Traditional Name: 2,6-dimethyl-3-nitro-benzoic acid 2-(dibutylamino)ethyl ester Formula: C19H30N2O4 MolecularWeight: 350.4525

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCOC(=O)C1=C(C=CC(=C1C)[N+](=O)[O-])C

Isomeric SMILES

CCCCN(CCCC)CCOC(=O)C1=C(C=CC(=C1C)[N+](=O)[O-])C

InChI

InChI=1S/C19H30N2O4/c1-5-7-11-20(12-8-6-2)13-14-25-19(22)18-15(3)9-10-17(16(18)4)21(23)24/h9-10H,5-8,11-14H2,1-4H3