ethyl 1-[[1-[(5-fluoranyl-2-methyl-phenyl)methyl]aziridin-2-yl]carbonylamino]cyclopropane-1-carboxylate

Systemtic Name: ethyl 1-[[1-[(5-fluoranyl-2-methyl-phenyl)methyl]aziridin-2-yl]carbonylamino]cyclopropane-1-carboxylate Openeye Name: ethyl 1-[[1-[(5-fluoro-2-methyl-phenyl)methyl]aziridine-2-carbonyl]amino]cyclopropanecarboxylate CAS Name: 1-[[[1-[(5-fluoro-2-methylphenyl)methyl]-2-aziridinyl]-oxomethyl]amino]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[1-[(5-fluoro-2-methylphenyl)methyl]aziridine-2-carbonyl]amino]cyclopropane-1-carboxylate Traditional Name: 1-[[1-(5-fluoro-2-methyl-benzyl)ethylenimine-2-carbonyl]amino]cyclopropanecarboxylic acid ethyl ester Formula: C17H21FN2O3 MolecularWeight: 320.358643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC1)NC(=O)C2CN2CC3=C(C=CC(=C3)F)C

Isomeric SMILES

CCOC(=O)C1(CC1)NC(=O)C2CN2CC3=C(C=CC(=C3)F)C

InChI

InChI=1S/C17H21FN2O3/c1-3-23-16(22)17(6-7-17)19-15(21)14-10-20(14)9-12-8-13(18)5-4-11(12)2/h4-5,8,14H,3,6-7,9-10H2,1-2H3,(H,19,21)