[(3R,4R)-3-phenyl-1-(phenylmethyl)piperidin-1-ium-4-yl]-(2-piperidin-1-ium-1-ylethyl)azanium

Systemtic Name: [(3R,4R)-3-phenyl-1-(phenylmethyl)piperidin-1-ium-4-yl]-(2-piperidin-1-ium-1-ylethyl)azanium Openeye Name: [(3R,4R)-1-benzyl-3-phenyl-piperidin-1-ium-4-yl]-(2-piperidin-1-ium-1-ylethyl)ammonium CAS Name: [(3R,4R)-3-phenyl-1-(phenylmethyl)-4-piperidin-1-iumyl]-[2-(1-piperidin-1-iumyl)ethyl]ammonium IUPAC Name: [(3R,4R)-1-benzyl-3-phenylpiperidin-1-ium-4-yl]-(2-piperidin-1-ium-1-ylethyl)azanium Traditional Name: [(3R,4R)-1-benzyl-3-phenyl-piperidin-1-ium-4-yl]-(2-piperidin-1-ium-1-ylethyl)ammonium Formula: C25H38N3+3 MolecularWeight: 380.58932

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC[NH2+]C2CC[NH+](CC2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](CC1)CC[NH2+][C@@H]2CC[NH+](C[C@H]2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H35N3/c1-4-10-22(11-5-1)20-28-18-14-25(24(21-28)23-12-6-2-7-13-23)26-15-19-27-16-8-3-9-17-27/h1-2,4-7,10-13,24-26H,3,8-9,14-21H2/p+3/t24-,25+/m0/s1