N-[(3-cyano-1-methyl-indol-2-yl)methyl]-N-phenyl-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[(3-cyano-1-methyl-indol-2-yl)methyl]-N-phenyl-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[(3-cyano-1-methyl-indol-2-yl)methyl]-N-phenyl-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[(3-cyano-1-methyl-2-indolyl)methyl]-N-phenyl-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[(3-cyano-1-methylindol-2-yl)methyl]-N-phenyl-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[(3-cyano-1-methyl-indol-2-yl)methyl]-N-phenyl-2-piperidin-1-ium-1-yl-acetamide Formula: C24H27N4O+ MolecularWeight: 387.49738

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1CN(C3=CC=CC=C3)C(=O)C[NH+]4CCCCC4)C#N

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1CN(C3=CC=CC=C3)C(=O)C[NH+]4CCCCC4)C#N

InChI

InChI=1S/C24H26N4O/c1-26-22-13-7-6-12-20(22)21(16-25)23(26)17-28(19-10-4-2-5-11-19)24(29)18-27-14-8-3-9-15-27/h2,4-7,10-13H,3,8-9,14-15,17-18H2,1H3/p+1