[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-chloro-4-isopropoxy-5-methoxy-phenyl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)methanone Traditional Name: (3-chloro-4-isopropoxy-5-methoxy-phenyl)-(4-piperonylpiperazino)methanone Formula: C23H27ClN2O5 MolecularWeight: 446.92388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C23H27ClN2O5/c1-15(2)31-22-18(24)11-17(12-21(22)28-3)23(27)26-8-6-25(7-9-26)13-16-4-5-19-20(10-16)30-14-29-19/h4-5,10-12,15H,6-9,13-14H2,1-3H3