4-(1,3-benzodioxol-5-ylamino)butanoate

Systemtic Name: 4-(1,3-benzodioxol-5-ylamino)butanoate Openeye Name: 4-(1,3-benzodioxol-5-ylamino)butanoate CAS Name: 4-(1,3-benzodioxol-5-ylamino)butanoate IUPAC Name: 4-(1,3-benzodioxol-5-ylamino)butanoate Traditional Name: 4-(1,3-benzodioxol-5-ylamino)butyrate Formula: C11H12NO4- MolecularWeight: 222.21728

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NCCCC(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NCCCC(=O)[O-]

InChI

InChI=1S/C11H13NO4/c13-11(14)2-1-5-12-8-3-4-9-10(6-8)16-7-15-9/h3-4,6,12H,1-2,5,7H2,(H,13,14)/p-1