methyl 2-azanylidenehept-6-ynoate hydrochloride

Systemtic Name: methyl 2-azanylidenehept-6-ynoate hydrochloride Openeye Name: methyl 2-iminohept-6-ynoate hydrochloride CAS Name: 2-imino-6-heptynoic acid methyl ester hydrochloride IUPAC Name: methyl 2-iminohept-6-ynoate hydrochloride Traditional Name: 2-iminohept-6-ynoic acid methyl ester hydrochloride Formula: C8H12ClNO2 MolecularWeight: 189.63938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=N)CCCC#C.Cl

Isomeric SMILES

COC(=O)C(=N)CCCC#C.Cl

InChI

InChI=1S/C8H11NO2.ClH/c1-3-4-5-6-7(9)8(10)11-2;/h1,9H,4-6H2,2H3;1H