1H-indole; 3-(3-nitropyridin-2-yl)oxypropanoic acid

Systemtic Name: 1H-indole; 3-(3-nitropyridin-2-yl)oxypropanoic acid Openeye Name: indole; 3-[(3-nitro-2-pyridyl)oxy]propanoic acid CAS Name: 1H-indole; 3-[(3-nitro-2-pyridinyl)oxy]propanoic acid IUPAC Name: 1H-indole; 3-(3-nitropyridin-2-yl)oxypropanoic acid Traditional Name: indole; 3-[(3-nitro-2-pyridyl)oxy]propionic acid Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN2.C1=CC(=C(N=C1)OCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CN2.C1=CC(=C(N=C1)OCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H8N2O5.C8H7N/c11-7(12)3-5-15-8-6(10(13)14)2-1-4-9-8;1-2-4-8-7(3-1)5-6-9-8/h1-2,4H,3,5H2,(H,11,12);1-6,9H