3-(3H-benzimidazol-5-ylamino)-4-[(2-hydroxyphenyl)methylamino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(3H-benzimidazol-5-ylamino)-4-[(2-hydroxyphenyl)methylamino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(3H-benzimidazol-5-ylamino)-4-[(2-hydroxyphenyl)methylamino]cyclobut-3-ene-1,2-dione CAS Name: 3-(3H-benzimidazol-5-ylamino)-4-[(2-hydroxyphenyl)methylamino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-(3H-benzimidazol-5-ylamino)-4-[(2-hydroxyphenyl)methylamino]cyclobut-3-ene-1,2-dione Traditional Name: 3-(3H-benzimidazol-5-ylamino)-4-(salicylamino)cyclobut-3-ene-1,2-quinone Formula: C18H14N4O3 MolecularWeight: 334.32876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=C(C(=O)C2=O)NC3=CC4=C(C=C3)N=CN4)O

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=C(C(=O)C2=O)NC3=CC4=C(C=C3)N=CN4)O

InChI

InChI=1S/C18H14N4O3/c23-14-4-2-1-3-10(14)8-19-15-16(18(25)17(15)24)22-11-5-6-12-13(7-11)21-9-20-12/h1-7,9,19,22-23H,8H2,(H,20,21)