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4-(3-ethyl-2,5-dimethyl-pyrrol-1-yl)benzoic acid

4-(3-ethyl-2,5-dimethyl-pyrrol-1-yl)benzoic acid

Systemtic Name:4-(3-ethyl-2,5-dimethyl-pyrrol-1-yl)benzoic acid
Openeye Name:4-(3-ethyl-2,5-dimethyl-pyrrol-1-yl)benzoic acid
CAS Name:4-(3-ethyl-2,5-dimethyl-1-pyrrolyl)benzoic acid
IUPAC Name:4-(3-ethyl-2,5-dimethylpyrrol-1-yl)benzoic acid
Traditional Name:4-(3-ethyl-2,5-dimethyl-pyrrol-1-yl)benzoic acid
Formula: C15H17NO2
MolecularWeight: 243.30098
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=C1)C)C2=CC=C(C=C2)C(=O)O)C


Isomeric SMILES

CCC1=C(N(C(=C1)C)C2=CC=C(C=C2)C(=O)O)C


InChI

InChI=1S/C15H17NO2/c1-4-12-9-10(2)16(11(12)3)14-7-5-13(6-8-14)15(17)18/h5-9H,4H2,1-3H3,(H,17,18)


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