(5R,6R)-2-(cyclopropylmethyl)-4-[(3-methoxy-4-oxidanyl-phenyl)methyl]-1,5-bis(phenylmethyl)-6-(2-trimethylsilylethoxymethoxy)-1,2,4-triazepan-3-one

Systemtic Name: (5R,6R)-2-(cyclopropylmethyl)-4-[(3-methoxy-4-oxidanyl-phenyl)methyl]-1,5-bis(phenylmethyl)-6-(2-trimethylsilylethoxymethoxy)-1,2,4-triazepan-3-one Openeye Name: (5R,6R)-1,5-dibenzyl-2-(cyclopropylmethyl)-4-[(4-hydroxy-3-methoxy-phenyl)methyl]-6-(2-trimethylsilylethoxymethoxy)-1,2,4-triazepan-3-one CAS Name: (5R,6R)-2-(cyclopropylmethyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]-1,5-bis(phenylmethyl)-6-(2-trimethylsilylethoxymethoxy)-1,2,4-triazepan-3-one IUPAC Name: (5R,6R)-1,5-dibenzyl-2-(cyclopropylmethyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]-6-(2-trimethylsilylethoxymethoxy)-1,2,4-triazepan-3-one Traditional Name: (5R,6R)-1,5-dibenzyl-2-(cyclopropylmethyl)-6-(2-trimethylsilylethoxymethoxy)-4-vanillyl-1,2,4-triazepan-3-one Formula: C36H49N3O5Si MolecularWeight: 631.87686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2C(C(CN(N(C2=O)CC3CC3)CC4=CC=CC=C4)OCOCC[Si](C)(C)C)CC5=CC=CC=C5)O

Isomeric SMILES

COC1=C(C=CC(=C1)CN2[C@@H]([C@@H](CN(N(C2=O)CC3CC3)CC4=CC=CC=C4)OCOCC[Si](C)(C)C)CC5=CC=CC=C5)O

InChI

InChI=1S/C36H49N3O5Si/c1-42-34-22-31(17-18-33(34)40)24-38-32(21-28-11-7-5-8-12-28)35(44-27-43-19-20-45(2,3)4)26-37(23-29-13-9-6-10-14-29)39(36(38)41)25-30-15-16-30/h5-14,17-18,22,30,32,35,40H,15-16,19-21,23-27H2,1-4H3/t32-,35-/m1/s1