(E)-3-[3,3-bis(ethoxycarbonyl)-5-methoxy-1,2-dihydroindol-2-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[3,3-bis(ethoxycarbonyl)-5-methoxy-1,2-dihydroindol-2-yl]prop-2-enoic acid Openeye Name: (E)-3-[3,3-bis(ethoxycarbonyl)-5-methoxy-indolin-2-yl]prop-2-enoic acid CAS Name: (E)-3-[3,3-bis(ethoxycarbonyl)-5-methoxy-1,2-dihydroindol-2-yl]-2-propenoic acid IUPAC Name: (E)-3-[3,3-bis(ethoxycarbonyl)-5-methoxy-1,2-dihydroindol-2-yl]prop-2-enoic acid Traditional Name: (E)-3-(3,3-dicarbethoxy-5-methoxy-indolin-2-yl)acrylic acid Formula: C18H21NO7 MolecularWeight: 363.36184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(NC2=C1C=C(C=C2)OC)C=CC(=O)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(C(NC2=C1C=C(C=C2)OC)/C=C/C(=O)O)C(=O)OCC

InChI

InChI=1S/C18H21NO7/c1-4-25-16(22)18(17(23)26-5-2)12-10-11(24-3)6-7-13(12)19-14(18)8-9-15(20)21/h6-10,14,19H,4-5H2,1-3H3,(H,20,21)/b9-8+