3-cyclohept-4-en-1-ylidene-2-methyl-pentanoic acid; methanamine

Systemtic Name: 3-cyclohept-4-en-1-ylidene-2-methyl-pentanoic acid; methanamine Openeye Name: 3-cyclohept-4-en-1-ylidene-2-methyl-pentanoic acid; methanamine CAS Name: 3-(1-cyclohept-4-enylidene)-2-methylpentanoic acid; methanamine IUPAC Name: 3-cyclohept-4-en-1-ylidene-2-methylpentanoic acid; methanamine Traditional Name: 3-cyclohept-4-en-1-ylidene-2-methyl-valeric acid; methylamine Formula: C14H25NO2 MolecularWeight: 239.3538

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1CCC=CCC1)C(C)C(=O)O.CN

Isomeric SMILES

CCC(=C1CCC=CCC1)C(C)C(=O)O.CN

InChI

InChI=1S/C13H20O2.CH5N/c1-3-12(10(2)13(14)15)11-8-6-4-5-7-9-11;1-2/h4-5,10H,3,6-9H2,1-2H3,(H,14,15);2H2,1H3