2-methylpropyl N'-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)carbonyl-carbamimidate

Systemtic Name: 2-methylpropyl N'-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)carbonyl-carbamimidate Openeye Name: N-[N-[2-(3,4-dimethoxyphenyl)ethyl]-C-isobutoxy-carbonimidoyl]-4-fluoro-benzamide CAS Name: N'-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(4-fluorophenyl)-oxomethyl]carbamimidic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N'-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorobenzoyl)carbamimidate Traditional Name: 4-fluoro-N-(N-homoveratryl-C-isobutoxy-carbonimidoyl)benzamide Formula: C22H27FN2O4 MolecularWeight: 402.459183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=NCCC1=CC(=C(C=C1)OC)OC)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)COC(=NCCC1=CC(=C(C=C1)OC)OC)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C22H27FN2O4/c1-15(2)14-29-22(25-21(26)17-6-8-18(23)9-7-17)24-12-11-16-5-10-19(27-3)20(13-16)28-4/h5-10,13,15H,11-12,14H2,1-4H3,(H,24,25,26)