N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethanamide

Systemtic Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethanamide Openeye Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)acetamide CAS Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-2-pyrrolyl)-2-(4-methyl-1-piperazine-1,4-diiumyl)acetamide IUPAC Name: N-(3-cyano-1-cyclohexyl-4,5-dimethylpyrrol-2-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)acetamide Traditional Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)acetamide Formula: C20H33N5O+2 MolecularWeight: 359.50892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)C[NH+]2CC[NH+](CC2)C)C3CCCCC3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)C[NH+]2CC[NH+](CC2)C)C3CCCCC3)C

InChI

InChI=1S/C20H31N5O/c1-15-16(2)25(17-7-5-4-6-8-17)20(18(15)13-21)22-19(26)14-24-11-9-23(3)10-12-24/h17H,4-12,14H2,1-3H3,(H,22,26)/p+2