3-[(6-chloranyl-1H-benzimidazol-5-yl)amino]-4-[(3-hydroxyphenyl)methylamino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[(6-chloranyl-1H-benzimidazol-5-yl)amino]-4-[(3-hydroxyphenyl)methylamino]cyclobut-3-ene-1,2-dione Openeye Name: 3-[(6-chloro-1H-benzimidazol-5-yl)amino]-4-[(3-hydroxyphenyl)methylamino]cyclobut-3-ene-1,2-dione CAS Name: 3-[(6-chloro-1H-benzimidazol-5-yl)amino]-4-[(3-hydroxyphenyl)methylamino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-[(6-chloro-1H-benzimidazol-5-yl)amino]-4-[(3-hydroxyphenyl)methylamino]cyclobut-3-ene-1,2-dione Traditional Name: 3-[(6-chloro-1H-benzimidazol-5-yl)amino]-4-[(3-hydroxybenzyl)amino]cyclobut-3-ene-1,2-quinone Formula: C18H13ClN4O3 MolecularWeight: 368.77382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)CNC2=C(C(=O)C2=O)NC3=C(C=C4C(=C3)N=CN4)Cl

Isomeric SMILES

C1=CC(=CC(=C1)O)CNC2=C(C(=O)C2=O)NC3=C(C=C4C(=C3)N=CN4)Cl

InChI

InChI=1S/C18H13ClN4O3/c19-11-5-13-14(22-8-21-13)6-12(11)23-16-15(17(25)18(16)26)20-7-9-2-1-3-10(24)4-9/h1-6,8,20,23-24H,7H2,(H,21,22)