2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(6-chloranyl-4-oxidanylidene-3-phenyl-chromen-2-yl)ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(6-chloranyl-4-oxidanylidene-3-phenyl-chromen-2-yl)ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(6-chloro-4-oxo-3-phenyl-chromen-2-yl)acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-(6-chloro-4-oxo-3-phenyl-1-benzopyran-2-yl)acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(6-chloro-4-oxo-3-phenylchromen-2-yl)acetamide Traditional Name: N-(6-chloro-4-keto-3-phenyl-chromen-2-yl)-2-(4-piperonylpiperazino)acetamide Formula: C29H26ClN3O5 MolecularWeight: 531.98684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=C(C(=O)C5=C(O4)C=CC(=C5)Cl)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=C(C(=O)C5=C(O4)C=CC(=C5)Cl)C6=CC=CC=C6

InChI

InChI=1S/C29H26ClN3O5/c30-21-7-9-23-22(15-21)28(35)27(20-4-2-1-3-5-20)29(38-23)31-26(34)17-33-12-10-32(11-13-33)16-19-6-8-24-25(14-19)37-18-36-24/h1-9,14-15H,10-13,16-18H2,(H,31,34)