(4-methoxyphenyl)-[(3S,4S)-4-(4-methoxyphenyl)carbonyl-1-methyl-pyrrolidin-1-ium-3-yl]methanone

Systemtic Name: (4-methoxyphenyl)-[(3S,4S)-4-(4-methoxyphenyl)carbonyl-1-methyl-pyrrolidin-1-ium-3-yl]methanone Openeye Name: [(3S,4S)-4-(4-methoxybenzoyl)-1-methyl-pyrrolidin-1-ium-3-yl]-(4-methoxyphenyl)methanone CAS Name: (4-methoxyphenyl)-[(3S,4S)-4-[(4-methoxyphenyl)-oxomethyl]-1-methyl-3-pyrrolidin-1-iumyl]methanone IUPAC Name: [(3S,4S)-4-(4-methoxybenzoyl)-1-methylpyrrolidin-1-ium-3-yl]-(4-methoxyphenyl)methanone Traditional Name: (4-methoxyphenyl)-[(3S,4S)-1-methyl-4-p-anisoyl-pyrrolidin-1-ium-3-yl]methanone Formula: C21H24NO4+ MolecularWeight: 354.41956

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC(C(C1)C(=O)C2=CC=C(C=C2)OC)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO4/c1-22-12-18(20(23)14-4-8-16(25-2)9-5-14)19(13-22)21(24)15-6-10-17(26-3)11-7-15/h4-11,18-19H,12-13H2,1-3H3/p+1/t18-,19-/m1/s1