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

Systemtic Name: [(3S,4S)-1-(4-methoxyphenyl)carbonyl-4-oxidanyl-pyrrolidin-3-yl]-methyl-(1,2-oxazol-3-ylmethyl)azanium Openeye Name: [(3S,4S)-4-hydroxy-1-(4-methoxybenzoyl)pyrrolidin-3-yl]-(isoxazol-3-ylmethyl)-methyl-ammonium CAS Name: [(3S,4S)-4-hydroxy-1-[(4-methoxyphenyl)-oxomethyl]-3-pyrrolidinyl]-(3-isoxazolylmethyl)-methylammonium IUPAC Name: [(3S,4S)-4-hydroxy-1-(4-methoxybenzoyl)pyrrolidin-3-yl]-methyl-(1,2-oxazol-3-ylmethyl)azanium Traditional Name: [(3S,4S)-4-hydroxy-1-p-anisoyl-pyrrolidin-3-yl]-(isoxazol-3-ylmethyl)-methyl-ammonium Formula: C17H22N3O4+ MolecularWeight: 332.37428

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NOC=C1)C2CN(CC2O)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+](CC1=NOC=C1)[C@H]2CN(C[C@@H]2O)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C17H21N3O4/c1-19(9-13-7-8-24-18-13)15-10-20(11-16(15)21)17(22)12-3-5-14(23-2)6-4-12/h3-8,15-16,21H,9-11H2,1-2H3/p+1/t15-,16-/m0/s1