[2-oxidanylidene-2-[[1-(phenylmethyl)pyrrolidin-3-yl]amino]ethyl] 3-fluoranyl-4-methyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[[1-(phenylmethyl)pyrrolidin-3-yl]amino]ethyl] 3-fluoranyl-4-methyl-benzoate Openeye Name: [2-[(1-benzylpyrrolidin-3-yl)amino]-2-oxo-ethyl] 3-fluoro-4-methyl-benzoate CAS Name: 3-fluoro-4-methylbenzoic acid [2-oxo-2-[[1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl] ester IUPAC Name: [2-[(1-benzylpyrrolidin-3-yl)amino]-2-oxoethyl] 3-fluoro-4-methylbenzoate Traditional Name: 3-fluoro-4-methyl-benzoic acid [2-[(1-benzylpyrrolidin-3-yl)amino]-2-keto-ethyl] ester Formula: C21H23FN2O3 MolecularWeight: 370.417323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NC2CCN(C2)CC3=CC=CC=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NC2CCN(C2)CC3=CC=CC=C3)F

InChI

InChI=1S/C21H23FN2O3/c1-15-7-8-17(11-19(15)22)21(26)27-14-20(25)23-18-9-10-24(13-18)12-16-5-3-2-4-6-16/h2-8,11,18H,9-10,12-14H2,1H3,(H,23,25)