N-cyclohexyl-2-(4-methanoylpiperazin-1-yl)-2-(6-nitro-1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: N-cyclohexyl-2-(4-methanoylpiperazin-1-yl)-2-(6-nitro-1,3-benzodioxol-5-yl)ethanamide Openeye Name: N-cyclohexyl-2-(4-formylpiperazin-1-yl)-2-(6-nitro-1,3-benzodioxol-5-yl)acetamide CAS Name: N-cyclohexyl-2-(4-formyl-1-piperazinyl)-2-(6-nitro-1,3-benzodioxol-5-yl)acetamide IUPAC Name: N-cyclohexyl-2-(4-formylpiperazin-1-yl)-2-(6-nitro-1,3-benzodioxol-5-yl)acetamide Traditional Name: N-cyclohexyl-2-(4-formylpiperazino)-2-(6-nitro-1,3-benzodioxol-5-yl)acetamide Formula: C20H26N4O6 MolecularWeight: 418.44364

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC3=C(C=C2[N+](=O)[O-])OCO3)N4CCN(CC4)C=O

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC3=C(C=C2[N+](=O)[O-])OCO3)N4CCN(CC4)C=O

InChI

InChI=1S/C20H26N4O6/c25-12-22-6-8-23(9-7-22)19(20(26)21-14-4-2-1-3-5-14)15-10-17-18(30-13-29-17)11-16(15)24(27)28/h10-12,14,19H,1-9,13H2,(H,21,26)