3-(3,4-dimethoxy-5-phenylmethoxy-phenyl)-N-[(1S)-2-(3-methoxy-4-oxidanyl-phenyl)-1-tritio-ethyl]propanamide

Systemtic Name: 3-(3,4-dimethoxy-5-phenylmethoxy-phenyl)-N-[(1S)-2-(3-methoxy-4-oxidanyl-phenyl)-1-tritio-ethyl]propanamide Openeye Name: 3-(3-benzyloxy-4,5-dimethoxy-phenyl)-N-[(1S)-2-(4-hydroxy-3-methoxy-phenyl)-1-tritio-ethyl]propanamide CAS Name: 3-(3,4-dimethoxy-5-phenylmethoxyphenyl)-N-[(1S)-2-(4-hydroxy-3-methoxyphenyl)-1-tritioethyl]propanamide IUPAC Name: 3-(3,4-dimethoxy-5-phenylmethoxyphenyl)-N-[(1S)-2-(4-hydroxy-3-methoxyphenyl)-1-tritioethyl]propanamide Traditional Name: 3-(3-benzoxy-4,5-dimethoxy-phenyl)-N-[(1S)-2-(4-hydroxy-3-methoxy-phenyl)-1-tritio-ethyl]propionamide Formula: C27H31NO6 MolecularWeight: 467.546249

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCNC(=O)CCC2=CC(=C(C(=C2)OCC3=CC=CC=C3)OC)OC)O

Isomeric SMILES

[H][C@]([3H])(CC1=CC(=C(C=C1)O)OC)NC(=O)CCC2=CC(=C(C(=C2)OCC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C27H31NO6/c1-31-23-15-19(9-11-22(23)29)13-14-28-26(30)12-10-21-16-24(32-2)27(33-3)25(17-21)34-18-20-7-5-4-6-8-20/h4-9,11,15-17,29H,10,12-14,18H2,1-3H3,(H,28,30)/i14T/t14-/m0/s1