2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-yl-ethyl]ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-yl-ethyl]ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[2-(4-ethoxy-3-methoxy-phenyl)-2-morpholino-ethyl]acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[2-(4-ethoxy-3-methoxyphenyl)-2-(4-morpholinyl)ethyl]acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[2-(4-ethoxy-3-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[2-(4-ethoxy-3-methoxy-phenyl)-2-morpholino-ethyl]acetamide Formula: C22H31N5O6 MolecularWeight: 461.51144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(CNC(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C)N3CCOCC3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(CNC(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C)N3CCOCC3)OC

InChI

InChI=1S/C22H31N5O6/c1-5-33-19-7-6-17(12-20(19)31-4)18(25-8-10-32-11-9-25)13-23-21(28)14-26-16(3)22(27(29)30)15(2)24-26/h6-7,12,18H,5,8-11,13-14H2,1-4H3,(H,23,28)