(E)-3-ethoxycarbonyl-4-(8-fluoranyl-5-methoxy-1-propan-2-yloxy-naphthalen-2-yl)but-3-enoic acid

Systemtic Name: (E)-3-ethoxycarbonyl-4-(8-fluoranyl-5-methoxy-1-propan-2-yloxy-naphthalen-2-yl)but-3-enoic acid Openeye Name: (E)-3-ethoxycarbonyl-4-(8-fluoro-1-isopropoxy-5-methoxy-2-naphthyl)but-3-enoic acid CAS Name: (E)-3-ethoxycarbonyl-4-(8-fluoro-5-methoxy-1-propan-2-yloxy-2-naphthalenyl)-3-butenoic acid IUPAC Name: (E)-3-ethoxycarbonyl-4-(8-fluoro-5-methoxy-1-propan-2-yloxynaphthalen-2-yl)but-3-enoic acid Traditional Name: (E)-3-carbethoxy-4-(8-fluoro-1-isopropoxy-5-methoxy-2-naphthyl)but-3-enoic acid Formula: C21H23FO6 MolecularWeight: 390.402123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(C2=C(C=CC(=C2C=C1)OC)F)OC(C)C)CC(=O)O

Isomeric SMILES

CCOC(=O)/C(=C/C1=C(C2=C(C=CC(=C2C=C1)OC)F)OC(C)C)/CC(=O)O

InChI

InChI=1S/C21H23FO6/c1-5-27-21(25)14(11-18(23)24)10-13-6-7-15-17(26-4)9-8-16(22)19(15)20(13)28-12(2)3/h6-10,12H,5,11H2,1-4H3,(H,23,24)/b14-10+