(3S)-1-[(3-cyclopentyloxyphenyl)methyl]-3-pyrrolidin-1-yl-piperidin-1-ium

Systemtic Name: (3S)-1-[(3-cyclopentyloxyphenyl)methyl]-3-pyrrolidin-1-yl-piperidin-1-ium Openeye Name: (3S)-1-[[3-(cyclopentoxy)phenyl]methyl]-3-pyrrolidin-1-yl-piperidin-1-ium CAS Name: (3S)-1-[(3-cyclopentyloxyphenyl)methyl]-3-(1-pyrrolidinyl)piperidin-1-ium IUPAC Name: (3S)-1-[(3-cyclopentyloxyphenyl)methyl]-3-pyrrolidin-1-ylpiperidin-1-ium Traditional Name: (3S)-1-[3-(cyclopentoxy)benzyl]-3-pyrrolidino-piperidin-1-ium Formula: C21H33N2O+ MolecularWeight: 329.49952

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=CC=CC(=C2)C[NH+]3CCCC(C3)N4CCCC4

Isomeric SMILES

C1CCC(C1)OC2=CC=CC(=C2)C[NH+]3CCC[C@@H](C3)N4CCCC4

InChI

InChI=1S/C21H32N2O/c1-2-10-20(9-1)24-21-11-5-7-18(15-21)16-22-12-6-8-19(17-22)23-13-3-4-14-23/h5,7,11,15,19-20H,1-4,6,8-10,12-14,16-17H2/p+1/t19-/m0/s1