bis(phenylmethyl)-[(2R)-2-(3,4,5-trimethoxyphenyl)carbonyloxypropyl]azanium

Systemtic Name: bis(phenylmethyl)-[(2R)-2-(3,4,5-trimethoxyphenyl)carbonyloxypropyl]azanium Openeye Name: dibenzyl-[(2R)-2-(3,4,5-trimethoxybenzoyl)oxypropyl]ammonium CAS Name: [(2R)-2-[oxo-(3,4,5-trimethoxyphenyl)methoxy]propyl]-bis(phenylmethyl)ammonium IUPAC Name: dibenzyl-[(2R)-2-(3,4,5-trimethoxybenzoyl)oxypropyl]azanium Traditional Name: dibenzyl-[(2R)-2-(3,4,5-trimethoxybenzoyl)oxypropyl]ammonium Formula: C27H32NO5+ MolecularWeight: 450.54668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+](CC1=CC=CC=C1)CC2=CC=CC=C2)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

C[C@H](C[NH+](CC1=CC=CC=C1)CC2=CC=CC=C2)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C27H31NO5/c1-20(33-27(29)23-15-24(30-2)26(32-4)25(16-23)31-3)17-28(18-21-11-7-5-8-12-21)19-22-13-9-6-10-14-22/h5-16,20H,17-19H2,1-4H3/p+1/t20-/m1/s1