(Z)-2-[2-[(2-ethoxyphenoxy)methyl]-3-methoxy-pyrrolidin-3-yl]but-2-enedioic acid

Systemtic Name: (Z)-2-[2-[(2-ethoxyphenoxy)methyl]-3-methoxy-pyrrolidin-3-yl]but-2-enedioic acid Openeye Name: (Z)-2-[2-[(2-ethoxyphenoxy)methyl]-3-methoxy-pyrrolidin-3-yl]but-2-enedioic acid CAS Name: (Z)-2-[2-[(2-ethoxyphenoxy)methyl]-3-methoxy-3-pyrrolidinyl]-2-butenedioic acid IUPAC Name: (Z)-2-[2-[(2-ethoxyphenoxy)methyl]-3-methoxypyrrolidin-3-yl]but-2-enedioic acid Traditional Name: (Z)-2-[2-[(2-ethoxyphenoxy)methyl]-3-methoxy-pyrrolidin-3-yl]but-2-enedioic acid Formula: C18H23NO7 MolecularWeight: 365.37772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCC2C(CCN2)(C(=CC(=O)O)C(=O)O)OC

Isomeric SMILES

CCOC1=CC=CC=C1OCC2C(CCN2)(/C(=C/C(=O)O)/C(=O)O)OC

InChI

InChI=1S/C18H23NO7/c1-3-25-13-6-4-5-7-14(13)26-11-15-18(24-2,8-9-19-15)12(17(22)23)10-16(20)21/h4-7,10,15,19H,3,8-9,11H2,1-2H3,(H,20,21)(H,22,23)/b12-10+