tert-butyl (2S)-2-[(3-cyanoindol-1-yl)methyl]aziridine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(3-cyanoindol-1-yl)methyl]aziridine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(3-cyanoindol-1-yl)methyl]aziridine-1-carboxylate CAS Name: (2S)-2-[(3-cyano-1-indolyl)methyl]-1-aziridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(3-cyanoindol-1-yl)methyl]aziridine-1-carboxylate Traditional Name: (2S)-2-[(3-cyanoindol-1-yl)methyl]ethylenimine-1-carboxylic acid tert-butyl ester Formula: C17H19N3O2 MolecularWeight: 297.35166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC1CN2C=C(C3=CC=CC=C32)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H]1CN2C=C(C3=CC=CC=C32)C#N

InChI

InChI=1S/C17H19N3O2/c1-17(2,3)22-16(21)20-11-13(20)10-19-9-12(8-18)14-6-4-5-7-15(14)19/h4-7,9,13H,10-11H2,1-3H3/t13-,20?/m0/s1