7-(4-ethoxy-3-fluoranyl-phenyl)-1-methanoyl-2,3-dihydro-1-benzazepine-4-carboxylic acid

Systemtic Name: 7-(4-ethoxy-3-fluoranyl-phenyl)-1-methanoyl-2,3-dihydro-1-benzazepine-4-carboxylic acid Openeye Name: 7-(4-ethoxy-3-fluoro-phenyl)-1-formyl-2,3-dihydro-1-benzazepine-4-carboxylic acid CAS Name: 7-(4-ethoxy-3-fluorophenyl)-1-formyl-2,3-dihydro-1-benzazepine-4-carboxylic acid IUPAC Name: 7-(4-ethoxy-3-fluorophenyl)-1-formyl-2,3-dihydro-1-benzazepine-4-carboxylic acid Traditional Name: 7-(4-ethoxy-3-fluoro-phenyl)-1-formyl-2,3-dihydro-1-benzazepine-4-carboxylic acid Formula: C20H18FNO4 MolecularWeight: 355.359623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)O)C=O)F

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)O)C=O)F

InChI

InChI=1S/C20H18FNO4/c1-2-26-19-6-4-14(11-17(19)21)13-3-5-18-16(9-13)10-15(20(24)25)7-8-22(18)12-23/h3-6,9-12H,2,7-8H2,1H3,(H,24,25)