[1-(6-methylpyridin-3-yl)-2-morpholin-4-yl-ethyl] 4-nitrobenzoate

Systemtic Name: [1-(6-methylpyridin-3-yl)-2-morpholin-4-yl-ethyl] 4-nitrobenzoate Openeye Name: [1-(6-methyl-3-pyridyl)-2-morpholino-ethyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [1-(6-methyl-3-pyridinyl)-2-(4-morpholinyl)ethyl] ester IUPAC Name: [1-(6-methylpyridin-3-yl)-2-morpholin-4-ylethyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [1-(6-methyl-3-pyridyl)-2-morpholino-ethyl] ester Formula: C19H21N3O5 MolecularWeight: 371.38714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(CN2CCOCC2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(C=C1)C(CN2CCOCC2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O5/c1-14-2-3-16(12-20-14)18(13-21-8-10-26-11-9-21)27-19(23)15-4-6-17(7-5-15)22(24)25/h2-7,12,18H,8-11,13H2,1H3