1-(4-butylphenyl)pyrrole-2-carboxylate

Systemtic Name: 1-(4-butylphenyl)pyrrole-2-carboxylate Openeye Name: 1-(4-butylphenyl)pyrrole-2-carboxylate CAS Name: 1-(4-butylphenyl)-2-pyrrolecarboxylate IUPAC Name: 1-(4-butylphenyl)pyrrole-2-carboxylate Traditional Name: 1-(4-butylphenyl)pyrrole-2-carboxylate Formula: C15H16NO2- MolecularWeight: 242.29304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C=CC=C2C(=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C=CC=C2C(=O)[O-]

InChI

InChI=1S/C15H17NO2/c1-2-3-5-12-7-9-13(10-8-12)16-11-4-6-14(16)15(17)18/h4,6-11H,2-3,5H2,1H3,(H,17,18)/p-1