4-bromanyl-2-(4-propan-2-ylpiperazin-1-yl)benzoic acid

Systemtic Name: 4-bromanyl-2-(4-propan-2-ylpiperazin-1-yl)benzoic acid Openeye Name: 4-bromo-2-(4-isopropylpiperazin-1-yl)benzoic acid CAS Name: 4-bromo-2-(4-propan-2-yl-1-piperazinyl)benzoic acid IUPAC Name: 4-bromo-2-(4-propan-2-ylpiperazin-1-yl)benzoic acid Traditional Name: 4-bromo-2-(4-isopropylpiperazino)benzoic acid Formula: C14H19BrN2O2 MolecularWeight: 327.21686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C2=C(C=CC(=C2)Br)C(=O)O

Isomeric SMILES

CC(C)N1CCN(CC1)C2=C(C=CC(=C2)Br)C(=O)O

InChI

InChI=1S/C14H19BrN2O2/c1-10(2)16-5-7-17(8-6-16)13-9-11(15)3-4-12(13)14(18)19/h3-4,9-10H,5-8H2,1-2H3,(H,18,19)