ethyl (2S,3R)-1-hexyl-3-naphthalen-2-yl-aziridine-2-carboxylate

Systemtic Name: ethyl (2S,3R)-1-hexyl-3-naphthalen-2-yl-aziridine-2-carboxylate Openeye Name: ethyl (2S,3R)-1-hexyl-3-(2-naphthyl)aziridine-2-carboxylate CAS Name: (2S,3R)-1-hexyl-3-(2-naphthalenyl)-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,3R)-1-hexyl-3-naphthalen-2-ylaziridine-2-carboxylate Traditional Name: (2S,3R)-1-hexyl-3-(2-naphthyl)ethylenimine-2-carboxylic acid ethyl ester Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(C1C(=O)OCC)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCCCN1[C@@H]([C@H]1C(=O)OCC)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H27NO2/c1-3-5-6-9-14-22-19(20(22)21(23)24-4-2)18-13-12-16-10-7-8-11-17(16)15-18/h7-8,10-13,15,19-20H,3-6,9,14H2,1-2H3/t19-,20+,22?/m1/s1