(3S)-1-[(3R)-1-phenylpyrrolidin-3-yl]-3-propoxy-piperidin-1-ium

Systemtic Name: (3S)-1-[(3R)-1-phenylpyrrolidin-3-yl]-3-propoxy-piperidin-1-ium Openeye Name: (3S)-1-[(3R)-1-phenylpyrrolidin-3-yl]-3-propoxy-piperidin-1-ium CAS Name: (3S)-1-[(3R)-1-phenyl-3-pyrrolidinyl]-3-propoxypiperidin-1-ium IUPAC Name: (3S)-1-[(3R)-1-phenylpyrrolidin-3-yl]-3-propoxypiperidin-1-ium Traditional Name: (3S)-1-[(3R)-1-phenylpyrrolidin-3-yl]-3-propoxy-piperidin-1-ium Formula: C18H29N2O+ MolecularWeight: 289.43566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1CCC[NH+](C1)C2CCN(C2)C3=CC=CC=C3

Isomeric SMILES

CCCO[C@H]1CCC[NH+](C1)[C@@H]2CCN(C2)C3=CC=CC=C3

InChI

InChI=1S/C18H28N2O/c1-2-13-21-18-9-6-11-19(15-18)17-10-12-20(14-17)16-7-4-3-5-8-16/h3-5,7-8,17-18H,2,6,9-15H2,1H3/p+1/t17-,18+/m1/s1