4-[2-[(1S)-3-oxidanylidene-1-(2-phenyl-1H-indol-3-yl)-1H-isoindol-2-yl]ethanoyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[2-[(1S)-3-oxidanylidene-1-(2-phenyl-1H-indol-3-yl)-1H-isoindol-2-yl]ethanoyl]piperazine-1-carbaldehyde Openeye Name: 4-[2-[(3S)-1-oxo-3-(2-phenyl-1H-indol-3-yl)isoindolin-2-yl]acetyl]piperazine-1-carbaldehyde CAS Name: 4-[1-oxo-2-[(1S)-3-oxo-1-(2-phenyl-1H-indol-3-yl)-1H-isoindol-2-yl]ethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[2-[(1S)-3-oxo-1-(2-phenyl-1H-indol-3-yl)-1H-isoindol-2-yl]acetyl]piperazine-1-carbaldehyde Traditional Name: 4-[2-[(3S)-1-keto-3-(2-phenyl-1H-indol-3-yl)isoindolin-2-yl]acetyl]piperazine-1-carbaldehyde Formula: C29H26N4O3 MolecularWeight: 478.54174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C(=O)CN2C(C3=CC=CC=C3C2=O)C4=C(NC5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C=O)C(=O)CN2[C@@H](C3=CC=CC=C3C2=O)C4=C(NC5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C29H26N4O3/c34-19-31-14-16-32(17-15-31)25(35)18-33-28(21-10-4-5-11-22(21)29(33)36)26-23-12-6-7-13-24(23)30-27(26)20-8-2-1-3-9-20/h1-13,19,28,30H,14-18H2/t28-/m0/s1