heptadecyl pyrrole-1-carboxylate

Systemtic Name: heptadecyl pyrrole-1-carboxylate Openeye Name: heptadecyl pyrrole-1-carboxylate CAS Name: 1-pyrrolecarboxylic acid heptadecyl ester IUPAC Name: heptadecyl pyrrole-1-carboxylate Traditional Name: pyrrole-1-carboxylic acid heptadecyl ester Formula: C22H39NO2 MolecularWeight: 349.55056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOC(=O)N1C=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCOC(=O)N1C=CC=C1

InChI

InChI=1S/C22H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-25-22(24)23-19-16-17-20-23/h16-17,19-20H,2-15,18,21H2,1H3