(5-ethylpyridin-2-yl)methyl-[(3S,4S)-1-(4-methoxyphenyl)carbonyl-4-oxidanyl-pyrrolidin-3-yl]-methyl-azanium

Systemtic Name: (5-ethylpyridin-2-yl)methyl-[(3S,4S)-1-(4-methoxyphenyl)carbonyl-4-oxidanyl-pyrrolidin-3-yl]-methyl-azanium Openeye Name: (5-ethyl-2-pyridyl)methyl-[(3S,4S)-4-hydroxy-1-(4-methoxybenzoyl)pyrrolidin-3-yl]-methyl-ammonium CAS Name: (5-ethyl-2-pyridinyl)methyl-[(3S,4S)-4-hydroxy-1-[(4-methoxyphenyl)-oxomethyl]-3-pyrrolidinyl]-methylammonium IUPAC Name: (5-ethylpyridin-2-yl)methyl-[(3S,4S)-4-hydroxy-1-(4-methoxybenzoyl)pyrrolidin-3-yl]-methylazanium Traditional Name: (5-ethyl-2-pyridyl)methyl-[(3S,4S)-4-hydroxy-1-p-anisoyl-pyrrolidin-3-yl]-methyl-ammonium Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)C[NH+](C)C2CN(CC2O)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC1=CN=C(C=C1)C[NH+](C)[C@H]2CN(C[C@@H]2O)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H27N3O3/c1-4-15-5-8-17(22-11-15)12-23(2)19-13-24(14-20(19)25)21(26)16-6-9-18(27-3)10-7-16/h5-11,19-20,25H,4,12-14H2,1-3H3/p+1/t19-,20-/m0/s1