2-[(R)-[phenyl(piperidin-1-yl)phosphoryl]-piperidin-1-ium-1-yl-methyl]phenol

Systemtic Name: 2-[(R)-[phenyl(piperidin-1-yl)phosphoryl]-piperidin-1-ium-1-yl-methyl]phenol Openeye Name: 2-[(R)-[phenyl(1-piperidyl)phosphoryl]-piperidin-1-ium-1-yl-methyl]phenol CAS Name: 2-[(R)-[phenyl(1-piperidinyl)phosphoryl]-(1-piperidin-1-iumyl)methyl]phenol IUPAC Name: 2-[(R)-[phenyl(piperidin-1-yl)phosphoryl]-piperidin-1-ium-1-ylmethyl]phenol Traditional Name: 2-[(R)-[phenyl(piperidino)phosphoryl]-piperidin-1-ium-1-yl-methyl]phenol Formula: C23H32N2O2P+ MolecularWeight: 399.486141

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(C2=CC=CC=C2O)P(=O)(C3=CC=CC=C3)N4CCCCC4

Isomeric SMILES

C1CC[NH+](CC1)[C@@H](C2=CC=CC=C2O)[P@@](=O)(C3=CC=CC=C3)N4CCCCC4

InChI

InChI=1S/C23H31N2O2P/c26-22-15-7-6-14-21(22)23(24-16-8-2-9-17-24)28(27,20-12-4-1-5-13-20)25-18-10-3-11-19-25/h1,4-7,12-15,23,26H,2-3,8-11,16-19H2/p+1/t23-,28+/m1/s1