methyl (3R,5S)-7-(3-aminocarbonylpyridin-4-yl)-5-oxidanyl-3-phenylmethoxy-heptanoate

Systemtic Name: methyl (3R,5S)-7-(3-aminocarbonylpyridin-4-yl)-5-oxidanyl-3-phenylmethoxy-heptanoate Openeye Name: methyl (3R,5S)-3-benzyloxy-7-(3-carbamoyl-4-pyridyl)-5-hydroxy-heptanoate CAS Name: (3R,5S)-7-(3-carbamoyl-4-pyridinyl)-5-hydroxy-3-phenylmethoxyheptanoic acid methyl ester IUPAC Name: methyl (3R,5S)-7-(3-carbamoylpyridin-4-yl)-5-hydroxy-3-phenylmethoxyheptanoate Traditional Name: (3R,5S)-3-benzoxy-7-(3-carbamoyl-4-pyridyl)-5-hydroxy-enanthic acid methyl ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC(CCC1=C(C=NC=C1)C(=O)N)O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C[C@@H](C[C@H](CCC1=C(C=NC=C1)C(=O)N)O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O5/c1-27-20(25)12-18(28-14-15-5-3-2-4-6-15)11-17(24)8-7-16-9-10-23-13-19(16)21(22)26/h2-6,9-10,13,17-18,24H,7-8,11-12,14H2,1H3,(H2,22,26)/t17-,18+/m0/s1