N-[2-(diethylamino)-3-methyl-butyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide

Systemtic Name: N-[2-(diethylamino)-3-methyl-butyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Openeye Name: N-[2-(diethylamino)-3-methyl-butyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide CAS Name: N-[2-(diethylamino)-3-methylbutyl]-4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]benzamide IUPAC Name: N-[2-(diethylamino)-3-methylbutyl]-4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzamide Traditional Name: N-[2-(diethylamino)-3-methyl-butyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Formula: C22H33N5O3 MolecularWeight: 415.52912

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=CC=C(C=C1)CN2C(=C(C(=N2)C)[N+](=O)[O-])C)C(C)C

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=CC=C(C=C1)CN2C(=C(C(=N2)C)[N+](=O)[O-])C)C(C)C

InChI

InChI=1S/C22H33N5O3/c1-7-25(8-2)20(15(3)4)13-23-22(28)19-11-9-18(10-12-19)14-26-17(6)21(27(29)30)16(5)24-26/h9-12,15,20H,7-8,13-14H2,1-6H3,(H,23,28)