(3,4-dimethoxyphenyl)-[(3S)-1-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]piperidin-3-yl]methanone

Systemtic Name: (3,4-dimethoxyphenyl)-[(3S)-1-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]piperidin-3-yl]methanone Openeye Name: (3,4-dimethoxyphenyl)-[(3S)-1-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-3-piperidyl]methanone CAS Name: (3,4-dimethoxyphenyl)-[(3S)-1-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-3-piperidinyl]methanone IUPAC Name: (3,4-dimethoxyphenyl)-[(3S)-1-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]piperidin-3-yl]methanone Traditional Name: (3,4-dimethoxyphenyl)-[(3S)-1-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-3-piperidyl]methanone Formula: C20H28N3O3+ MolecularWeight: 358.45462

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(NC=C1)CN2CCCC(C2)C(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC[N+]1=C(NC=C1)CN2CCC[C@@H](C2)C(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H27N3O3/c1-4-23-11-9-21-19(23)14-22-10-5-6-16(13-22)20(24)15-7-8-17(25-2)18(12-15)26-3/h7-9,11-12,16H,4-6,10,13-14H2,1-3H3/p+1/t16-/m0/s1