2-[C-methyl-N-(phenylmethyl)carbonimidoyl]hexanoate

Systemtic Name: 2-[C-methyl-N-(phenylmethyl)carbonimidoyl]hexanoate Openeye Name: 2-(N-benzyl-C-methyl-carbonimidoyl)hexanoate CAS Name: 2-[1-(phenylmethyl)iminoethyl]hexanoate IUPAC Name: 2-(N-benzyl-C-methylcarbonimidoyl)hexanoate Traditional Name: 2-(N-benzyl-C-methyl-carbonimidoyl)hexanoate Formula: C15H20NO2- MolecularWeight: 246.3248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=NCC1=CC=CC=C1)C)C(=O)[O-]

Isomeric SMILES

CCCCC(C(=NCC1=CC=CC=C1)C)C(=O)[O-]

InChI

InChI=1S/C15H21NO2/c1-3-4-10-14(15(17)18)12(2)16-11-13-8-6-5-7-9-13/h5-9,14H,3-4,10-11H2,1-2H3,(H,17,18)/p-1