2-azanylethanol; 4-(pyridin-3-ylcarbonylamino)butanoic acid

Systemtic Name: 2-azanylethanol; 4-(pyridin-3-ylcarbonylamino)butanoic acid Openeye Name: 2-aminoethanol; 4-(pyridine-3-carbonylamino)butanoic acid CAS Name: 2-aminoethanol; 4-[[oxo(3-pyridinyl)methyl]amino]butanoic acid IUPAC Name: 2-aminoethanol; 4-(pyridine-3-carbonylamino)butanoic acid Traditional Name: 2-aminoethanol; 4-nicotinamidobutyric acid Formula: C12H19N3O4 MolecularWeight: 269.29696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)NCCCC(=O)O.C(CO)N

Isomeric SMILES

C1=CC(=CN=C1)C(=O)NCCCC(=O)O.C(CO)N

InChI

InChI=1S/C10H12N2O3.C2H7NO/c13-9(14)4-2-6-12-10(15)8-3-1-5-11-7-8;3-1-2-4/h1,3,5,7H,2,4,6H2,(H,12,15)(H,13,14);4H,1-3H2