N-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(1H-indol-3-yl)-3-oxo-isoindolin-2-yl]propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]propanamide Traditional Name: 3-[(1R)-1-(1H-indol-3-yl)-3-keto-isoindolin-2-yl]-N-piperonyl-propionamide Formula: C27H23N3O4 MolecularWeight: 453.48922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCN3C(C4=CC=CC=C4C3=O)C5=CNC6=CC=CC=C65

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCN3[C@H](C4=CC=CC=C4C3=O)C5=CNC6=CC=CC=C65

InChI

InChI=1S/C27H23N3O4/c31-25(29-14-17-9-10-23-24(13-17)34-16-33-23)11-12-30-26(19-6-1-2-7-20(19)27(30)32)21-15-28-22-8-4-3-5-18(21)22/h1-10,13,15,26,28H,11-12,14,16H2,(H,29,31)/t26-/m1/s1