4-imidazol-1-yl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-yl-ethyl]-3-nitro-benzamide

Systemtic Name: 4-imidazol-1-yl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-yl-ethyl]-3-nitro-benzamide Openeye Name: 4-imidazol-1-yl-N-[2-(5-methyl-2-furyl)-2-morpholino-ethyl]-3-nitro-benzamide CAS Name: 4-(1-imidazolyl)-N-[2-(5-methyl-2-furanyl)-2-(4-morpholinyl)ethyl]-3-nitrobenzamide IUPAC Name: 4-imidazol-1-yl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-nitrobenzamide Traditional Name: 4-imidazol-1-yl-N-[2-(5-methyl-2-furyl)-2-morpholino-ethyl]-3-nitro-benzamide Formula: C21H23N5O5 MolecularWeight: 425.43782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(CNC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

CC1=CC=C(O1)C(CNC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C21H23N5O5/c1-15-2-5-20(31-15)19(24-8-10-30-11-9-24)13-23-21(27)16-3-4-17(18(12-16)26(28)29)25-7-6-22-14-25/h2-7,12,14,19H,8-11,13H2,1H3,(H,23,27)