N-[2-(dimethylamino)-3-methyl-butyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[2-(dimethylamino)-3-methyl-butyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[2-(dimethylamino)-3-methyl-butyl]-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[2-(dimethylamino)-3-methylbutyl]-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[2-(dimethylamino)-3-methylbutyl]-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[2-(dimethylamino)-3-methyl-butyl]-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C20H32N4O3 MolecularWeight: 376.49308

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NCC(C(C)C)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NCC(C(C)C)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H32N4O3/c1-14(2)19(22(4)5)12-21-20(25)16-8-9-17(18(11-16)24(26)27)23-10-6-7-15(3)13-23/h8-9,11,14-15,19H,6-7,10,12-13H2,1-5H3,(H,21,25)