(3E)-3-[[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-bromanyl-indol-3-yl]methylidene]-1H-indol-2-one

Systemtic Name: (3E)-3-[[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-bromanyl-indol-3-yl]methylidene]-1H-indol-2-one Openeye Name: (3E)-3-[[1-[2-(azepan-1-yl)-2-oxo-ethyl]-5-bromo-indol-3-yl]methylene]indolin-2-one CAS Name: (3E)-3-[[1-[2-(1-azepanyl)-2-oxoethyl]-5-bromo-3-indolyl]methylidene]-1H-indol-2-one IUPAC Name: (3E)-3-[[1-[2-(azepan-1-yl)-2-oxoethyl]-5-bromoindol-3-yl]methylidene]-1H-indol-2-one Traditional Name: (3E)-3-[[1-[2-(azepan-1-yl)-2-keto-ethyl]-5-bromo-indol-3-yl]methylene]oxindole Formula: C25H24BrN3O2 MolecularWeight: 478.38096

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C=C(C3=C2C=CC(=C3)Br)C=C4C5=CC=CC=C5NC4=O

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C=C(C3=C2C=CC(=C3)Br)/C=C/4\C5=CC=CC=C5NC4=O

InChI

InChI=1S/C25H24BrN3O2/c26-18-9-10-23-20(14-18)17(13-21-19-7-3-4-8-22(19)27-25(21)31)15-29(23)16-24(30)28-11-5-1-2-6-12-28/h3-4,7-10,13-15H,1-2,5-6,11-12,16H2,(H,27,31)/b21-13+