3-methoxy-4-(pyridin-4-ylmethylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-methoxy-4-(pyridin-4-ylmethylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-methoxy-4-(4-pyridylmethylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-methoxy-4-(pyridin-4-ylmethylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-methoxy-4-(pyridin-4-ylmethylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-methoxy-4-(4-pyridylmethylamino)cyclobut-3-ene-1,2-quinone Formula: C11H10N2O3 MolecularWeight: 218.2087

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C1=O)NCC2=CC=NC=C2

Isomeric SMILES

COC1=C(C(=O)C1=O)NCC2=CC=NC=C2

InChI

InChI=1S/C11H10N2O3/c1-16-11-8(9(14)10(11)15)13-6-7-2-4-12-5-3-7/h2-5,13H,6H2,1H3