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2-[5-(3-ethylphenyl)carbonyl-2,3-dihydropyrrol-1-yl]pyrrole-1-carboxylic acid

2-[5-(3-ethylphenyl)carbonyl-2,3-dihydropyrrol-1-yl]pyrrole-1-carboxylic acid

Systemtic Name:2-[5-(3-ethylphenyl)carbonyl-2,3-dihydropyrrol-1-yl]pyrrole-1-carboxylic acid
Openeye Name:2-[5-(3-ethylbenzoyl)-2,3-dihydropyrrol-1-yl]pyrrole-1-carboxylic acid
CAS Name:2-[5-[(3-ethylphenyl)-oxomethyl]-2,3-dihydropyrrol-1-yl]-1-pyrrolecarboxylic acid
IUPAC Name:2-[5-(3-ethylbenzoyl)-2,3-dihydropyrrol-1-yl]pyrrole-1-carboxylic acid
Traditional Name:2-[2-(3-ethylbenzoyl)-2-pyrrolin-1-yl]pyrrole-1-carboxylic acid
Formula: C18H18N2O3
MolecularWeight: 310.34712
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1)C(=O)C2=CCCN2C3=CC=CN3C(=O)O


Isomeric SMILES

CCC1=CC=CC(=C1)C(=O)C2=CCCN2C3=CC=CN3C(=O)O


InChI

InChI=1S/C18H18N2O3/c1-2-13-6-3-7-14(12-13)17(21)15-8-4-10-19(15)16-9-5-11-20(16)18(22)23/h3,5-9,11-12H,2,4,10H2,1H3,(H,22,23)


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