3-bromanyl-4-[3-(dimethylamino)propoxy]-5-ethoxy-benzoic acid

Systemtic Name: 3-bromanyl-4-[3-(dimethylamino)propoxy]-5-ethoxy-benzoic acid Openeye Name: 3-bromo-4-[3-(dimethylamino)propoxy]-5-ethoxy-benzoic acid CAS Name: 3-bromo-4-[3-(dimethylamino)propoxy]-5-ethoxybenzoic acid IUPAC Name: 3-bromo-4-[3-(dimethylamino)propoxy]-5-ethoxybenzoic acid Traditional Name: 3-bromo-4-[3-(dimethylamino)propoxy]-5-ethoxy-benzoic acid Formula: C14H20BrNO4 MolecularWeight: 346.2169

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)O)Br)OCCCN(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)O)Br)OCCCN(C)C

InChI

InChI=1S/C14H20BrNO4/c1-4-19-12-9-10(14(17)18)8-11(15)13(12)20-7-5-6-16(2)3/h8-9H,4-7H2,1-3H3,(H,17,18)