4-[(2R)-2-(3-cyclopentyloxy-4-methoxy-phenyl)-2-phenyl-ethyl]-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 4-[(2R)-2-(3-cyclopentyloxy-4-methoxy-phenyl)-2-phenyl-ethyl]-1-oxidanidyl-pyridin-1-ium Openeye Name: 4-[(2R)-2-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-phenyl-ethyl]-1-oxido-pyridin-1-ium CAS Name: 4-[(2R)-2-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethyl]-1-oxidopyridin-1-ium IUPAC Name: 4-[(2R)-2-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethyl]-1-oxidopyridin-1-ium Traditional Name: 4-[(2R)-2-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-phenyl-ethyl]-1-oxido-pyridin-1-ium Formula: C25H27NO3 MolecularWeight: 389.48678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC2=CC=[N+](C=C2)[O-])C3=CC=CC=C3)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H](CC2=CC=[N+](C=C2)[O-])C3=CC=CC=C3)OC4CCCC4

InChI

InChI=1S/C25H27NO3/c1-28-24-12-11-21(18-25(24)29-22-9-5-6-10-22)23(20-7-3-2-4-8-20)17-19-13-15-26(27)16-14-19/h2-4,7-8,11-16,18,22-23H,5-6,9-10,17H2,1H3/t23-/m1/s1