2-[1-(4-bromophenyl)propylamino]benzoic acid

Systemtic Name: 2-[1-(4-bromophenyl)propylamino]benzoic acid Openeye Name: 2-[1-(4-bromophenyl)propylamino]benzoic acid CAS Name: 2-[1-(4-bromophenyl)propylamino]benzoic acid IUPAC Name: 2-[1-(4-bromophenyl)propylamino]benzoic acid Traditional Name: 2-[1-(4-bromophenyl)propylamino]benzoic acid Formula: C16H16BrNO2 MolecularWeight: 334.20774

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

CCC(C1=CC=C(C=C1)Br)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H16BrNO2/c1-2-14(11-7-9-12(17)10-8-11)18-15-6-4-3-5-13(15)16(19)20/h3-10,14,18H,2H2,1H3,(H,19,20)