1-[[(E)-but-2-enyl]carbamoylamino]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[[(E)-but-2-enyl]carbamoylamino]cycloheptane-1-carboxylic acid Openeye Name: 1-[[(E)-but-2-enyl]carbamoylamino]cycloheptanecarboxylic acid CAS Name: 1-[[[[(E)-but-2-enyl]amino]-oxomethyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[[(E)-but-2-enyl]carbamoylamino]cycloheptane-1-carboxylic acid Traditional Name: 1-[[(E)-but-2-enyl]carbamoylamino]cycloheptanecarboxylic acid Formula: C13H22N2O3 MolecularWeight: 254.32538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N2O3/c1-2-3-10-14-12(18)15-13(11(16)17)8-6-4-5-7-9-13/h2-3H,4-10H2,1H3,(H,16,17)(H2,14,15,18)/b3-2+