(2S)-1-[(2S,3S)-2,3-bis(phenylmethoxymethyl)aziridin-1-yl]-2-methyl-3-phenyl-propan-1-one

Systemtic Name: (2S)-1-[(2S,3S)-2,3-bis(phenylmethoxymethyl)aziridin-1-yl]-2-methyl-3-phenyl-propan-1-one Openeye Name: (2S)-1-[(2S,3S)-2,3-bis(benzyloxymethyl)aziridin-1-yl]-2-methyl-3-phenyl-propan-1-one CAS Name: (2S)-1-[(2S,3S)-2,3-bis(phenylmethoxymethyl)-1-aziridinyl]-2-methyl-3-phenyl-1-propanone IUPAC Name: (2S)-1-[(2S,3S)-2,3-bis(phenylmethoxymethyl)aziridin-1-yl]-2-methyl-3-phenylpropan-1-one Traditional Name: (2S)-1-[(2S,3S)-2,3-bis(benzoxymethyl)ethylenimin-1-yl]-2-methyl-3-phenyl-propan-1-one Formula: C28H31NO3 MolecularWeight: 429.55064

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)C(=O)N2C(C2COCC3=CC=CC=C3)COCC4=CC=CC=C4

Isomeric SMILES

C[C@@H](CC1=CC=CC=C1)C(=O)N2[C@@H]([C@H]2COCC3=CC=CC=C3)COCC4=CC=CC=C4

InChI

InChI=1S/C28H31NO3/c1-22(17-23-11-5-2-6-12-23)28(30)29-26(20-31-18-24-13-7-3-8-14-24)27(29)21-32-19-25-15-9-4-10-16-25/h2-16,22,26-27H,17-21H2,1H3/t22-,26+,27+/m0/s1