3-azanyl-1-(thiophen-3-ylmethoxy)heptan-2-one

Systemtic Name: 3-azanyl-1-(thiophen-3-ylmethoxy)heptan-2-one Openeye Name: 3-amino-1-(3-thienylmethoxy)heptan-2-one CAS Name: 3-amino-1-(3-thiophenylmethoxy)-2-heptanone IUPAC Name: 3-amino-1-(thiophen-3-ylmethoxy)heptan-2-one Traditional Name: 3-amino-1-(3-thenyloxy)heptan-2-one Formula: C12H19NO2S MolecularWeight: 241.34976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)COCC1=CSC=C1)N

Isomeric SMILES

CCCCC(C(=O)COCC1=CSC=C1)N

InChI

InChI=1S/C12H19NO2S/c1-2-3-4-11(13)12(14)8-15-7-10-5-6-16-9-10/h5-6,9,11H,2-4,7-8,13H2,1H3