2-[bis(prop-2-enyl)amino]-4-bromanyl-benzoic acid

Systemtic Name: 2-[bis(prop-2-enyl)amino]-4-bromanyl-benzoic acid Openeye Name: 4-bromo-2-(diallylamino)benzoic acid CAS Name: 2-[bis(prop-2-enyl)amino]-4-bromobenzoic acid IUPAC Name: 2-[bis(prop-2-enyl)amino]-4-bromobenzoic acid Traditional Name: 4-bromo-2-(diallylamino)benzoic acid Formula: C13H14BrNO2 MolecularWeight: 296.15976

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC=C)C1=C(C=CC(=C1)Br)C(=O)O

Isomeric SMILES

C=CCN(CC=C)C1=C(C=CC(=C1)Br)C(=O)O

InChI

InChI=1S/C13H14BrNO2/c1-3-7-15(8-4-2)12-9-10(14)5-6-11(12)13(16)17/h3-6,9H,1-2,7-8H2,(H,16,17)