[2-[[(2S)-heptan-2-yl]amino]-2-oxidanylidene-ethyl] 2-(6-methyl-1-benzofuran-3-yl)ethanoate

Systemtic Name: [2-[[(2S)-heptan-2-yl]amino]-2-oxidanylidene-ethyl] 2-(6-methyl-1-benzofuran-3-yl)ethanoate Openeye Name: [2-[[(1S)-1-methylhexyl]amino]-2-oxo-ethyl] 2-(6-methylbenzofuran-3-yl)acetate CAS Name: 2-(6-methyl-3-benzofuranyl)acetic acid [2-[[(2S)-heptan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-heptan-2-yl]amino]-2-oxoethyl] 2-(6-methyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-methylbenzofuran-3-yl)acetic acid [2-keto-2-[[(1S)-1-methylhexyl]amino]ethyl] ester Formula: C20H27NO4 MolecularWeight: 345.43268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)COC(=O)CC1=COC2=C1C=CC(=C2)C

Isomeric SMILES

CCCCC[C@H](C)NC(=O)COC(=O)CC1=COC2=C1C=CC(=C2)C

InChI

InChI=1S/C20H27NO4/c1-4-5-6-7-15(3)21-19(22)13-25-20(23)11-16-12-24-18-10-14(2)8-9-17(16)18/h8-10,12,15H,4-7,11,13H2,1-3H3,(H,21,22)/t15-/m0/s1