3-(1,3-benzodioxol-5-yl)-3-(cyclohexylcarbonylamino)propanoic acid

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-3-(cyclohexylcarbonylamino)propanoic acid Openeye Name: 3-(1,3-benzodioxol-5-yl)-3-(cyclohexanecarbonylamino)propanoic acid CAS Name: 3-(1,3-benzodioxol-5-yl)-3-[[cyclohexyl(oxo)methyl]amino]propanoic acid IUPAC Name: 3-(1,3-benzodioxol-5-yl)-3-(cyclohexanecarbonylamino)propanoic acid Traditional Name: 3-(1,3-benzodioxol-5-yl)-3-(cyclohexanecarbonylamino)propionic acid Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(CC(=O)O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCC(CC1)C(=O)NC(CC(=O)O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H21NO5/c19-16(20)9-13(18-17(21)11-4-2-1-3-5-11)12-6-7-14-15(8-12)23-10-22-14/h6-8,11,13H,1-5,9-10H2,(H,18,21)(H,19,20)