1-[[(2E,4E)-hexa-2,4-dienoyl]amino]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[[(2E,4E)-hexa-2,4-dienoyl]amino]cycloheptane-1-carboxylic acid Openeye Name: 1-[[(2E,4E)-hexa-2,4-dienoyl]amino]cycloheptanecarboxylic acid CAS Name: 1-[[(2E,4E)-1-oxohexa-2,4-dienyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[[(2E,4E)-hexa-2,4-dienoyl]amino]cycloheptane-1-carboxylic acid Traditional Name: 1-[[(2E,4E)-hexa-2,4-dienoyl]amino]cycloheptanecarboxylic acid Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)NC1(CCCCCC1)C(=O)O

Isomeric SMILES

C/C=C/C=C/C(=O)NC1(CCCCCC1)C(=O)O

InChI

InChI=1S/C14H21NO3/c1-2-3-6-9-12(16)15-14(13(17)18)10-7-4-5-8-11-14/h2-3,6,9H,4-5,7-8,10-11H2,1H3,(H,15,16)(H,17,18)/b3-2+,9-6+