3-bromanyl-4-(ethylamino)-5-methoxycarbonyl-benzoic acid

Systemtic Name: 3-bromanyl-4-(ethylamino)-5-methoxycarbonyl-benzoic acid Openeye Name: 3-bromo-4-(ethylamino)-5-methoxycarbonyl-benzoic acid CAS Name: 3-bromo-4-(ethylamino)-5-methoxycarbonylbenzoic acid IUPAC Name: 3-bromo-4-(ethylamino)-5-methoxycarbonylbenzoic acid Traditional Name: 3-bromo-5-carbomethoxy-4-(ethylamino)benzoic acid Formula: C11H12BrNO4 MolecularWeight: 302.12128

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1Br)C(=O)O)C(=O)OC

Isomeric SMILES

CCNC1=C(C=C(C=C1Br)C(=O)O)C(=O)OC

InChI

InChI=1S/C11H12BrNO4/c1-3-13-9-7(11(16)17-2)4-6(10(14)15)5-8(9)12/h4-5,13H,3H2,1-2H3,(H,14,15)