ethyl 2-[1-(phenylmethyl)piperidin-1-ium-4-ylidene]ethanoate

Systemtic Name: ethyl 2-[1-(phenylmethyl)piperidin-1-ium-4-ylidene]ethanoate Openeye Name: ethyl 2-(1-benzylpiperidin-1-ium-4-ylidene)acetate CAS Name: 2-[1-(phenylmethyl)-4-piperidin-1-iumylidene]acetic acid ethyl ester IUPAC Name: ethyl 2-(1-benzylpiperidin-1-ium-4-ylidene)acetate Traditional Name: 2-(1-benzylpiperidin-1-ium-4-ylidene)acetic acid ethyl ester Formula: C16H22NO2+ MolecularWeight: 260.35138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C=C1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C16H21NO2/c1-2-19-16(18)12-14-8-10-17(11-9-14)13-15-6-4-3-5-7-15/h3-7,12H,2,8-11,13H2,1H3/p+1