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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)butanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]butanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[5-chloro-2-(2-quinolinyl)-1H-indol-3-yl]butanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(5-chloro-2-quinolin-2-yl-1H-indol-3-yl)butanamide Traditional Name: 4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]-N-piperonyl-butyramide Formula: C29H24ClN3O3 MolecularWeight: 497.97216

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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=NC6=CC=CC=C6C=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCCC3=C(NC4=C3C=C(C=C4)Cl)C5=NC6=CC=CC=C6C=C5

InChI

InChI=1S/C29H24ClN3O3/c30-20-10-12-24-22(15-20)21(29(33-24)25-11-9-19-4-1-2-6-23(19)32-25)5-3-7-28(34)31-16-18-8-13-26-27(14-18)36-17-35-26/h1-2,4,6,8-15,33H,3,5,7,16-17H2,(H,31,34)