3-[[(E)-but-2-enyl]amino]-4-(pyridin-3-ylmethylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[(E)-but-2-enyl]amino]-4-(pyridin-3-ylmethylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-[[(E)-but-2-enyl]amino]-4-(3-pyridylmethylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-[[(E)-but-2-enyl]amino]-4-(3-pyridinylmethylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[[(E)-but-2-enyl]amino]-4-(pyridin-3-ylmethylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-[[(E)-but-2-enyl]amino]-4-(3-pyridylmethylamino)cyclobut-3-ene-1,2-quinone Formula: C14H15N3O2 MolecularWeight: 257.2878

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCNC1=C(C(=O)C1=O)NCC2=CN=CC=C2

Isomeric SMILES

C/C=C/CNC1=C(C(=O)C1=O)NCC2=CN=CC=C2

InChI

InChI=1S/C14H15N3O2/c1-2-3-7-16-11-12(14(19)13(11)18)17-9-10-5-4-6-15-8-10/h2-6,8,16-17H,7,9H2,1H3/b3-2+