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

Systemtic Name: 3-[1-(3-aminophenyl)ethylamino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-[1-(3-aminophenyl)ethylamino]-4-(4-pyridylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-[1-(3-aminophenyl)ethylamino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[1-(3-aminophenyl)ethylamino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-[1-(3-aminophenyl)ethylamino]-4-(4-pyridylamino)cyclobut-3-ene-1,2-quinone Formula: C17H16N4O2 MolecularWeight: 308.33454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N4O2/c1-10(11-3-2-4-12(18)9-11)20-14-15(17(23)16(14)22)21-13-5-7-19-8-6-13/h2-10,20H,18H2,1H3,(H,19,21)