(3S)-1-[(2-prop-2-enoxyphenyl)methyl]-3-pyrrolidin-1-yl-piperidin-1-ium

Systemtic Name: (3S)-1-[(2-prop-2-enoxyphenyl)methyl]-3-pyrrolidin-1-yl-piperidin-1-ium Openeye Name: (3S)-1-[(2-allyloxyphenyl)methyl]-3-pyrrolidin-1-yl-piperidin-1-ium CAS Name: (3S)-1-[(2-prop-2-enoxyphenyl)methyl]-3-(1-pyrrolidinyl)piperidin-1-ium IUPAC Name: (3S)-1-[(2-prop-2-enoxyphenyl)methyl]-3-pyrrolidin-1-ylpiperidin-1-ium Traditional Name: (3S)-1-(2-allyloxybenzyl)-3-pyrrolidino-piperidin-1-ium Formula: C19H29N2O+ MolecularWeight: 301.44636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC=C1C[NH+]2CCCC(C2)N3CCCC3

Isomeric SMILES

C=CCOC1=CC=CC=C1C[NH+]2CCC[C@@H](C2)N3CCCC3

InChI

InChI=1S/C19H28N2O/c1-2-14-22-19-10-4-3-8-17(19)15-20-11-7-9-18(16-20)21-12-5-6-13-21/h2-4,8,10,18H,1,5-7,9,11-16H2/p+1/t18-/m0/s1