ethyl 4-[(1E)-2,6-dimethylhepta-1,5-dienyl]-3-methyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[(1E)-2,6-dimethylhepta-1,5-dienyl]-3-methyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[(1E)-2,6-dimethylhepta-1,5-dienyl]-3-methyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(1E)-2,6-dimethylhepta-1,5-dienyl]-3-methyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(1E)-2,6-dimethylhepta-1,5-dienyl]-3-methyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(1E)-2,6-dimethylhepta-1,5-dienyl]-3-methyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C17H25NO2 MolecularWeight: 275.3859

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CN1)C=C(C)CCC=C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CN1)/C=C(\C)/CCC=C(C)C)C

InChI

InChI=1S/C17H25NO2/c1-6-20-17(19)16-14(5)15(11-18-16)10-13(4)9-7-8-12(2)3/h8,10-11,18H,6-7,9H2,1-5H3/b13-10+