(1-pyrrol-3-ylideneethylamino) hexanoate

Systemtic Name: (1-pyrrol-3-ylideneethylamino) hexanoate Openeye Name: (1-pyrrol-3-ylideneethylamino) hexanoate CAS Name: hexanoic acid [1-(3-pyrrolylidene)ethylamino] ester IUPAC Name: (1-pyrrol-3-ylideneethylamino) hexanoate Traditional Name: hexanoic acid (1-pyrrol-3-ylideneethylamino) ester Formula: C12H18N2O2 MolecularWeight: 222.28352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)ONC(=C1C=CN=C1)C

Isomeric SMILES

CCCCCC(=O)ONC(=C1C=CN=C1)C

InChI

InChI=1S/C12H18N2O2/c1-3-4-5-6-12(15)16-14-10(2)11-7-8-13-9-11/h7-9,14H,3-6H2,1-2H3