3-cyclohexa-1,4-dien-1-yl-2-(ethylcarbamoylamino)propanoic acid

Systemtic Name: 3-cyclohexa-1,4-dien-1-yl-2-(ethylcarbamoylamino)propanoic acid Openeye Name: 3-cyclohexa-1,4-dien-1-yl-2-(ethylcarbamoylamino)propanoic acid CAS Name: 3-(1-cyclohexa-1,4-dienyl)-2-(ethylcarbamoylamino)propanoic acid IUPAC Name: 3-cyclohexa-1,4-dien-1-yl-2-(ethylcarbamoylamino)propanoic acid Traditional Name: 3-cyclohexa-1,4-dien-1-yl-2-(ethylcarbamoylamino)propionic acid Formula: C12H18N2O3 MolecularWeight: 238.28292

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(CC1=CCC=CC1)C(=O)O

Isomeric SMILES

CCNC(=O)NC(CC1=CCC=CC1)C(=O)O

InChI

InChI=1S/C12H18N2O3/c1-2-13-12(17)14-10(11(15)16)8-9-6-4-3-5-7-9/h3-4,7,10H,2,5-6,8H2,1H3,(H,15,16)(H2,13,14,17)