(3,4-dimethoxyphenyl)-[(3S)-1-[(4-methoxyphenyl)methyl]piperidin-1-ium-3-yl]methanone

Systemtic Name: (3,4-dimethoxyphenyl)-[(3S)-1-[(4-methoxyphenyl)methyl]piperidin-1-ium-3-yl]methanone Openeye Name: (3,4-dimethoxyphenyl)-[(3S)-1-[(4-methoxyphenyl)methyl]piperidin-1-ium-3-yl]methanone CAS Name: (3,4-dimethoxyphenyl)-[(3S)-1-[(4-methoxyphenyl)methyl]-3-piperidin-1-iumyl]methanone IUPAC Name: (3,4-dimethoxyphenyl)-[(3S)-1-[(4-methoxyphenyl)methyl]piperidin-1-ium-3-yl]methanone Traditional Name: (3,4-dimethoxyphenyl)-[(3S)-1-p-anisylpiperidin-1-ium-3-yl]methanone Formula: C22H28NO4+ MolecularWeight: 370.46202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CCCC(C2)C(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CCC[C@@H](C2)C(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H27NO4/c1-25-19-9-6-16(7-10-19)14-23-12-4-5-18(15-23)22(24)17-8-11-20(26-2)21(13-17)27-3/h6-11,13,18H,4-5,12,14-15H2,1-3H3/p+1/t18-/m0/s1