2-[2-[3-[4-(1,3-benzodioxol-5-ylsulfonyl)piperazin-1-yl]carbonylphenyl]ethoxy]benzamide

Systemtic Name: 2-[2-[3-[4-(1,3-benzodioxol-5-ylsulfonyl)piperazin-1-yl]carbonylphenyl]ethoxy]benzamide Openeye Name: 2-[2-[3-[4-(1,3-benzodioxol-5-ylsulfonyl)piperazine-1-carbonyl]phenyl]ethoxy]benzamide CAS Name: 2-[2-[3-[[4-(1,3-benzodioxol-5-ylsulfonyl)-1-piperazinyl]-oxomethyl]phenyl]ethoxy]benzamide IUPAC Name: 2-[2-[3-[4-(1,3-benzodioxol-5-ylsulfonyl)piperazine-1-carbonyl]phenyl]ethoxy]benzamide Traditional Name: 2-[2-[3-[4-(1,3-benzodioxol-5-ylsulfonyl)piperazine-1-carbonyl]phenyl]ethoxy]benzamide Formula: C27H27N3O7S MolecularWeight: 537.58418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=CC=C2)CCOC3=CC=CC=C3C(=O)N)S(=O)(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=CC=C2)CCOC3=CC=CC=C3C(=O)N)S(=O)(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H27N3O7S/c28-26(31)22-6-1-2-7-23(22)35-15-10-19-4-3-5-20(16-19)27(32)29-11-13-30(14-12-29)38(33,34)21-8-9-24-25(17-21)37-18-36-24/h1-9,16-17H,10-15,18H2,(H2,28,31)