3-[5-(4-bromophenyl)-1-prop-2-enyl-pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[5-(4-bromophenyl)-1-prop-2-enyl-pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-allyl-5-(4-bromophenyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[5-(4-bromophenyl)-1-prop-2-enyl-2-pyrrolyl]propanoic acid IUPAC Name: 3-[5-(4-bromophenyl)-1-prop-2-enylpyrrol-2-yl]propanoic acid Traditional Name: 3-[1-allyl-5-(4-bromophenyl)pyrrol-2-yl]propionic acid Formula: C16H16BrNO2 MolecularWeight: 334.20774

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=CC=C1C2=CC=C(C=C2)Br)CCC(=O)O

Isomeric SMILES

C=CCN1C(=CC=C1C2=CC=C(C=C2)Br)CCC(=O)O

InChI

InChI=1S/C16H16BrNO2/c1-2-11-18-14(8-10-16(19)20)7-9-15(18)12-3-5-13(17)6-4-12/h2-7,9H,1,8,10-11H2,(H,19,20)