2-[[(1Z)-1-(2-oxidanylidene-1H-indol-3-ylidene)-3H-2-benzofuran-5-yl]amino]ethyl 2-(4-methylpiperazin-1-yl)ethanoate

Systemtic Name: 2-[[(1Z)-1-(2-oxidanylidene-1H-indol-3-ylidene)-3H-2-benzofuran-5-yl]amino]ethyl 2-(4-methylpiperazin-1-yl)ethanoate Openeye Name: 2-[[(1Z)-1-(2-oxoindolin-3-ylidene)-3H-isobenzofuran-5-yl]amino]ethyl 2-(4-methylpiperazin-1-yl)acetate CAS Name: 2-(4-methyl-1-piperazinyl)acetic acid 2-[[(1Z)-1-(2-oxo-1H-indol-3-ylidene)-3H-isobenzofuran-5-yl]amino]ethyl ester IUPAC Name: 2-[[(1Z)-1-(2-oxo-1H-indol-3-ylidene)-3H-2-benzofuran-5-yl]amino]ethyl 2-(4-methylpiperazin-1-yl)acetate Traditional Name: 2-(4-methylpiperazino)acetic acid 2-[[(1Z)-1-(2-ketoindolin-3-ylidene)phthalan-5-yl]amino]ethyl ester Formula: C25H28N4O4 MolecularWeight: 448.51422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(=O)OCCNC2=CC3=C(C=C2)C(=C4C5=CC=CC=C5NC4=O)OC3

Isomeric SMILES

CN1CCN(CC1)CC(=O)OCCNC2=CC3=C(C=C2)/C(=C/4\C5=CC=CC=C5NC4=O)/OC3

InChI

InChI=1S/C25H28N4O4/c1-28-9-11-29(12-10-28)15-22(30)32-13-8-26-18-6-7-19-17(14-18)16-33-24(19)23-20-4-2-3-5-21(20)27-25(23)31/h2-7,14,26H,8-13,15-16H2,1H3,(H,27,31)/b24-23-