N-(1,3-benzodioxol-5-ylmethyl)-4-(5-chloranyl-2-pyridin-2-yl-1H-indol-3-yl)butanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(5-chloranyl-2-pyridin-2-yl-1H-indol-3-yl)butanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]butanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[5-chloro-2-(2-pyridinyl)-1H-indol-3-yl]butanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(5-chloro-2-pyridin-2-yl-1H-indol-3-yl)butanamide Traditional Name: 4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]-N-piperonyl-butyramide Formula: C25H22ClN3O3 MolecularWeight: 447.91348

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCCC3=C(NC4=C3C=C(C=C4)Cl)C5=CC=CC=N5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCCC3=C(NC4=C3C=C(C=C4)Cl)C5=CC=CC=N5

InChI

InChI=1S/C25H22ClN3O3/c26-17-8-9-20-19(13-17)18(25(29-20)21-5-1-2-11-27-21)4-3-6-24(30)28-14-16-7-10-22-23(12-16)32-15-31-22/h1-2,5,7-13,29H,3-4,6,14-15H2,(H,28,30)