3-(aminomethyl)-2-(2-cyclohex-2-en-1-ylethyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 3-(aminomethyl)-2-(2-cyclohex-2-en-1-ylethyl)-4-oxidanylidene-butanoic acid Openeye Name: 3-(aminomethyl)-2-(2-cyclohex-2-en-1-ylethyl)-4-oxo-butanoic acid CAS Name: 3-(aminomethyl)-2-[2-(1-cyclohex-2-enyl)ethyl]-4-oxobutanoic acid IUPAC Name: 3-(aminomethyl)-2-(2-cyclohex-2-en-1-ylethyl)-4-oxobutanoic acid Traditional Name: 3-(aminomethyl)-2-(2-cyclohex-2-en-1-ylethyl)-4-keto-butyric acid Formula: C13H21NO3 MolecularWeight: 239.31074

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=CC(C1)CCC(C(CN)C=O)C(=O)O

Isomeric SMILES

C1CC=CC(C1)CCC(C(CN)C=O)C(=O)O

InChI

InChI=1S/C13H21NO3/c14-8-11(9-15)12(13(16)17)7-6-10-4-2-1-3-5-10/h2,4,9-12H,1,3,5-8,14H2,(H,16,17)