[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 2,5-dimethylbenzoate

Systemtic Name: [2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 2,5-dimethylbenzoate Openeye Name: [2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl] 2,5-dimethylbenzoate CAS Name: 2,5-dimethylbenzoic acid [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 2,5-dimethylbenzoate Traditional Name: 2,5-dimethylbenzoic acid [2-[(4-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C18H18FNO3 MolecularWeight: 315.338823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)OCC(=O)NCC2=CC=C(C=C2)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)OCC(=O)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C18H18FNO3/c1-12-3-4-13(2)16(9-12)18(22)23-11-17(21)20-10-14-5-7-15(19)8-6-14/h3-9H,10-11H2,1-2H3,(H,20,21)