ethyl (2R,3R)-1-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-hex-1-ynyl-aziridine-2-carboxylate

Systemtic Name: ethyl (2R,3R)-1-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-hex-1-ynyl-aziridine-2-carboxylate Openeye Name: ethyl (2R,3R)-1-(1,3-dioxoisoindolin-2-yl)-3-hex-1-ynyl-aziridine-2-carboxylate CAS Name: (2R,3R)-1-(1,3-dioxo-2-isoindolyl)-3-hex-1-ynyl-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R)-1-(1,3-dioxoisoindol-2-yl)-3-hex-1-ynylaziridine-2-carboxylate Traditional Name: (2R,3R)-3-hex-1-ynyl-1-phthalimido-ethylenimine-2-carboxylic acid ethyl ester Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1C(N1N2C(=O)C3=CC=CC=C3C2=O)C(=O)OCC

Isomeric SMILES

CCCCC#C[C@@H]1[C@@H](N1N2C(=O)C3=CC=CC=C3C2=O)C(=O)OCC

InChI

InChI=1S/C19H20N2O4/c1-3-5-6-7-12-15-16(19(24)25-4-2)20(15)21-17(22)13-10-8-9-11-14(13)18(21)23/h8-11,15-16H,3-6H2,1-2H3/t15-,16-,20?/m1/s1