3-[1-(3-hydroxyphenyl)ethylamino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[1-(3-hydroxyphenyl)ethylamino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-[1-(3-hydroxyphenyl)ethylamino]-4-(4-pyridylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-[1-(3-hydroxyphenyl)ethylamino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[1-(3-hydroxyphenyl)ethylamino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-[1-(3-hydroxyphenyl)ethylamino]-4-(4-pyridylamino)cyclobut-3-ene-1,2-quinone Formula: C17H15N3O3 MolecularWeight: 309.3193

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)O)NC2=C(C(=O)C2=O)NC3=CC=NC=C3

Isomeric SMILES

CC(C1=CC(=CC=C1)O)NC2=C(C(=O)C2=O)NC3=CC=NC=C3

InChI

InChI=1S/C17H15N3O3/c1-10(11-3-2-4-13(21)9-11)19-14-15(17(23)16(14)22)20-12-5-7-18-8-6-12/h2-10,19,21H,1H3,(H,18,20)