ethyl (2R,3R)-3-(4-bromophenyl)-1-(diphenylmethyl)-2-methyl-aziridine-2-carboxylate

Systemtic Name: ethyl (2R,3R)-3-(4-bromophenyl)-1-(diphenylmethyl)-2-methyl-aziridine-2-carboxylate Openeye Name: ethyl (2R,3R)-1-benzhydryl-3-(4-bromophenyl)-2-methyl-aziridine-2-carboxylate CAS Name: (2R,3R)-3-(4-bromophenyl)-1-(diphenylmethyl)-2-methyl-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R)-1-benzhydryl-3-(4-bromophenyl)-2-methylaziridine-2-carboxylate Traditional Name: (2R,3R)-1-benzhydryl-3-(4-bromophenyl)-2-methyl-ethylenimine-2-carboxylic acid ethyl ester Formula: C25H24BrNO2 MolecularWeight: 450.36756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(N1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CCOC(=O)[C@]1([C@H](N1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C25H24BrNO2/c1-3-29-24(28)25(2)23(20-14-16-21(26)17-15-20)27(25)22(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-17,22-23H,3H2,1-2H3/t23-,25-,27?/m1/s1