2,5-dimethyl-1-phenethyl-pyrrole-3-carboxylate

Systemtic Name: 2,5-dimethyl-1-phenethyl-pyrrole-3-carboxylate Openeye Name: 2,5-dimethyl-1-phenethyl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-phenethyl-3-pyrrolecarboxylate IUPAC Name: 2,5-dimethyl-1-phenethylpyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-phenethyl-pyrrole-3-carboxylate Formula: C15H16NO2- MolecularWeight: 242.29304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)[O-]

InChI

InChI=1S/C15H17NO2/c1-11-10-14(15(17)18)12(2)16(11)9-8-13-6-4-3-5-7-13/h3-7,10H,8-9H2,1-2H3,(H,17,18)/p-1