deuterio 2-methyl-5-phenyl-1H-pyrrole-3-carboxylate

Systemtic Name: deuterio 2-methyl-5-phenyl-1H-pyrrole-3-carboxylate Openeye Name: deuterio 2-methyl-5-phenyl-1H-pyrrole-3-carboxylate CAS Name: 2-methyl-5-phenyl-1H-pyrrole-3-carboxylic acid deuterio ester IUPAC Name: deuterio 2-methyl-5-phenyl-1H-pyrrole-3-carboxylate Traditional Name: 2-methyl-5-phenyl-1H-pyrrole-3-carboxylic acid deuterio ester Formula: C12H11NO2 MolecularWeight: 202.227402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

[2H]OC(=O)C1=C(NC(=C1)C2=CC=CC=C2)C

InChI

InChI=1S/C12H11NO2/c1-8-10(12(14)15)7-11(13-8)9-5-3-2-4-6-9/h2-7,13H,1H3,(H,14,15)/i/hD