4-(phthalazin-1-ylamino)butanoic acid

Systemtic Name: 4-(phthalazin-1-ylamino)butanoic acid Openeye Name: 4-(phthalazin-1-ylamino)butanoic acid CAS Name: 4-(1-phthalazinylamino)butanoic acid IUPAC Name: 4-(phthalazin-1-ylamino)butanoic acid Traditional Name: 4-(phthalazin-1-ylamino)butyric acid Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN=C2NCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=NN=C2NCCCC(=O)O

InChI

InChI=1S/C12H13N3O2/c16-11(17)6-3-7-13-12-10-5-2-1-4-9(10)8-14-15-12/h1-2,4-5,8H,3,6-7H2,(H,13,15)(H,16,17)