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

Systemtic Name: 3-(tert-butylamino)-4-(pyridin-3-ylmethylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-(tert-butylamino)-4-(3-pyridylmethylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-(tert-butylamino)-4-(3-pyridinylmethylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(tert-butylamino)-4-(pyridin-3-ylmethylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(tert-butylamino)-4-(3-pyridylmethylamino)cyclobut-3-ene-1,2-quinone Formula: C14H17N3O2 MolecularWeight: 259.30368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(C(=O)C1=O)NCC2=CN=CC=C2

Isomeric SMILES

CC(C)(C)NC1=C(C(=O)C1=O)NCC2=CN=CC=C2

InChI

InChI=1S/C14H17N3O2/c1-14(2,3)17-11-10(12(18)13(11)19)16-8-9-5-4-6-15-7-9/h4-7,16-17H,8H2,1-3H3