3-nitro-4-(pyridin-4-ylmethylamino)phenol

Systemtic Name: 3-nitro-4-(pyridin-4-ylmethylamino)phenol Openeye Name: 3-nitro-4-(4-pyridylmethylamino)phenol CAS Name: 3-nitro-4-(pyridin-4-ylmethylamino)phenol IUPAC Name: 3-nitro-4-(pyridin-4-ylmethylamino)phenol Traditional Name: 3-nitro-4-(4-pyridylmethylamino)phenol Formula: C12H11N3O3 MolecularWeight: 245.23404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)[N+](=O)[O-])NCC2=CC=NC=C2

Isomeric SMILES

C1=CC(=C(C=C1O)[N+](=O)[O-])NCC2=CC=NC=C2

InChI

InChI=1S/C12H11N3O3/c16-10-1-2-11(12(7-10)15(17)18)14-8-9-3-5-13-6-4-9/h1-7,14,16H,8H2