(2S)-2-[bis(phenylmethyl)amino]-3-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)propanal

Systemtic Name: (2S)-2-[bis(phenylmethyl)amino]-3-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)propanal Openeye Name: (2S)-2-(dibenzylamino)-3-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)propanal CAS Name: (2S)-2-[bis(phenylmethyl)amino]-3-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)propanal IUPAC Name: (2S)-2-(dibenzylamino)-3-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)propanal Traditional Name: (2S)-2-(dibenzylamino)-3-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)propionaldehyde Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

CC12COC(OC1)(OC2)CC(C=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC12COC(OC1)(OC2)C[C@@H](C=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H27NO4/c1-22-16-26-23(27-17-22,28-18-22)12-21(15-25)24(13-19-8-4-2-5-9-19)14-20-10-6-3-7-11-20/h2-11,15,21H,12-14,16-18H2,1H3/t21-,22?,23?/m0/s1