5-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]amino]pentanoate

Systemtic Name: 5-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]amino]pentanoate Openeye Name: 5-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]amino]pentanoate CAS Name: 5-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]amino]pentanoate IUPAC Name: 5-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]amino]pentanoate Traditional Name: 5-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]amino]valerate Formula: C16H22NO4- MolecularWeight: 292.35018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)NCCCCC(=O)[O-]

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)NCCCCC(=O)[O-]

InChI

InChI=1S/C16H23NO4/c1-3-20-15-9-12-8-11(2)21-14(12)10-13(15)17-7-5-4-6-16(18)19/h9-11,17H,3-8H2,1-2H3,(H,18,19)/p-1/t11-/m0/s1