1-[(E)-2-(4-methoxyphenyl)-3-piperidin-1-ium-1-ylidene-prop-1-enyl]piperidine

Systemtic Name: 1-[(E)-2-(4-methoxyphenyl)-3-piperidin-1-ium-1-ylidene-prop-1-enyl]piperidine Openeye Name: 1-[(E)-2-(4-methoxyphenyl)-3-piperidin-1-ium-1-ylidene-prop-1-enyl]piperidine CAS Name: 1-[(E)-2-(4-methoxyphenyl)-3-(1-piperidin-1-iumylidene)prop-1-enyl]piperidine IUPAC Name: 1-[(E)-2-(4-methoxyphenyl)-3-piperidin-1-ium-1-ylideneprop-1-enyl]piperidine Traditional Name: 1-[(E)-2-(4-methoxyphenyl)-3-piperidin-1-ium-1-ylidene-prop-1-enyl]piperidine Formula: C20H29N2O+ MolecularWeight: 313.45706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=CN2CCCCC2)C=[N+]3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)/C(=C\N2CCCCC2)/C=[N+]3CCCCC3

InChI

InChI=1S/C20H29N2O/c1-23-20-10-8-18(9-11-20)19(16-21-12-4-2-5-13-21)17-22-14-6-3-7-15-22/h8-11,16-17H,2-7,12-15H2,1H3/q+1