(2E)-7-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-2-(1H-indol-3-ylmethylidene)-6-oxidanyl-1-benzofuran-3-one

Systemtic Name: (2E)-7-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-2-(1H-indol-3-ylmethylidene)-6-oxidanyl-1-benzofuran-3-one Openeye Name: (2E)-7-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxy-2-(1H-indol-3-ylmethylene)benzofuran-3-one CAS Name: (2E)-7-[(4-ethyl-1-piperazine-1,4-diiumyl)methyl]-6-hydroxy-2-(1H-indol-3-ylmethylidene)-3-benzofuranone IUPAC Name: (2E)-7-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxy-2-(1H-indol-3-ylmethylidene)-1-benzofuran-3-one Traditional Name: (2E)-7-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxy-2-(1H-indol-3-ylmethylene)coumaran-3-one Formula: C24H27N3O3+2 MolecularWeight: 405.48948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC2=C(C=CC3=C2OC(=CC4=CNC5=CC=CC=C54)C3=O)O

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC2=C(C=CC3=C2O/C(=C/C4=CNC5=CC=CC=C54)/C3=O)O

InChI

InChI=1S/C24H25N3O3/c1-2-26-9-11-27(12-10-26)15-19-21(28)8-7-18-23(29)22(30-24(18)19)13-16-14-25-20-6-4-3-5-17(16)20/h3-8,13-14,25,28H,2,9-12,15H2,1H3/p+2/b22-13+