N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]-2-(4-phenylphenyl)ethanamide

Systemtic Name: N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]-2-(4-phenylphenyl)ethanamide Openeye Name: N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]-2-(4-phenylphenyl)acetamide CAS Name: N-[(3S)-1-(1-methyl-4-piperidin-1-iumyl)-3-piperidin-1-iumyl]-2-(4-phenylphenyl)acetamide IUPAC Name: N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]-2-(4-phenylphenyl)acetamide Traditional Name: N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]-2-(4-phenylphenyl)acetamide Formula: C25H35N3O+2 MolecularWeight: 393.5649

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+]2CCCC(C2)NC(=O)CC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+]2CCC[C@@H](C2)NC(=O)CC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H33N3O/c1-27-16-13-24(14-17-27)28-15-5-8-23(19-28)26-25(29)18-20-9-11-22(12-10-20)21-6-3-2-4-7-21/h2-4,6-7,9-12,23-24H,5,8,13-19H2,1H3,(H,26,29)/p+2/t23-/m0/s1