methyl (E)-2-methyl-7-(1H-pyrrol-3-yl)hept-6-enoate

Systemtic Name: methyl (E)-2-methyl-7-(1H-pyrrol-3-yl)hept-6-enoate Openeye Name: methyl (E)-2-methyl-7-(1H-pyrrol-3-yl)hept-6-enoate CAS Name: (E)-2-methyl-7-(1H-pyrrol-3-yl)-6-heptenoic acid methyl ester IUPAC Name: methyl (E)-2-methyl-7-(1H-pyrrol-3-yl)hept-6-enoate Traditional Name: (E)-2-methyl-7-(1H-pyrrol-3-yl)hept-6-enoic acid methyl ester Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC=CC1=CNC=C1)C(=O)OC

Isomeric SMILES

CC(CCC/C=C/C1=CNC=C1)C(=O)OC

InChI

InChI=1S/C13H19NO2/c1-11(13(15)16-2)6-4-3-5-7-12-8-9-14-10-12/h5,7-11,14H,3-4,6H2,1-2H3/b7-5+