[(E)-6-azanyl-6-oxidanylidene-5-(pentylamino)hex-3-enyl] ethanoate

Systemtic Name: [(E)-6-azanyl-6-oxidanylidene-5-(pentylamino)hex-3-enyl] ethanoate Openeye Name: [(E)-6-amino-6-oxo-5-(pentylamino)hex-3-enyl] acetate CAS Name: acetic acid [(E)-6-amino-6-oxo-5-(pentylamino)hex-3-enyl] ester IUPAC Name: [(E)-6-amino-6-oxo-5-(pentylamino)hex-3-enyl] acetate Traditional Name: acetic acid [(E)-6-amino-5-(amylamino)-6-keto-hex-3-enyl] ester Formula: C13H24N2O3 MolecularWeight: 256.34126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(C=CCCOC(=O)C)C(=O)N

Isomeric SMILES

CCCCCNC(/C=C/CCOC(=O)C)C(=O)N

InChI

InChI=1S/C13H24N2O3/c1-3-4-6-9-15-12(13(14)17)8-5-7-10-18-11(2)16/h5,8,12,15H,3-4,6-7,9-10H2,1-2H3,(H2,14,17)/b8-5+