4-oxa-1-azabicyclo[3.1.0]hexane; 3-(propanoylamino)benzoic acid

Systemtic Name: 4-oxa-1-azabicyclo[3.1.0]hexane; 3-(propanoylamino)benzoic acid Openeye Name: 4-oxa-1-azabicyclo[3.1.0]hexane; 3-(propanoylamino)benzoic acid CAS Name: 4-oxa-1-azabicyclo[3.1.0]hexane; 3-(1-oxopropylamino)benzoic acid IUPAC Name: 4-oxa-1-azabicyclo[3.1.0]hexane; 3-(propanoylamino)benzoic acid Traditional Name: 4-oxa-1-azabicyclo[3.1.0]hexane; 3-propionamidobenzoic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC(=C1)C(=O)O.C1COC2N1C2

Isomeric SMILES

CCC(=O)NC1=CC=CC(=C1)C(=O)O.C1COC2N1C2

InChI

InChI=1S/C10H11NO3.C4H7NO/c1-2-9(12)11-8-5-3-4-7(6-8)10(13)14;1-2-6-4-3-5(1)4/h3-6H,2H2,1H3,(H,11,12)(H,13,14);4H,1-3H2