1-[4-azanyl-2-(1,3-benzodioxol-5-ylmethoxy)-5-chloranyl-phenyl]-5-piperidin-1-yl-pentan-1-one

Systemtic Name: 1-[4-azanyl-2-(1,3-benzodioxol-5-ylmethoxy)-5-chloranyl-phenyl]-5-piperidin-1-yl-pentan-1-one Openeye Name: 1-[4-amino-2-(1,3-benzodioxol-5-ylmethoxy)-5-chloro-phenyl]-5-(1-piperidyl)pentan-1-one CAS Name: 1-[4-amino-2-(1,3-benzodioxol-5-ylmethoxy)-5-chlorophenyl]-5-(1-piperidinyl)-1-pentanone IUPAC Name: 1-[4-amino-2-(1,3-benzodioxol-5-ylmethoxy)-5-chlorophenyl]-5-piperidin-1-ylpentan-1-one Traditional Name: 1-(4-amino-5-chloro-2-piperonyloxy-phenyl)-5-piperidino-pentan-1-one Formula: C24H29ClN2O4 MolecularWeight: 444.95106

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCC(=O)C2=CC(=C(C=C2OCC3=CC4=C(C=C3)OCO4)N)Cl

Isomeric SMILES

C1CCN(CC1)CCCCC(=O)C2=CC(=C(C=C2OCC3=CC4=C(C=C3)OCO4)N)Cl

InChI

InChI=1S/C24H29ClN2O4/c25-19-13-18(21(28)6-2-5-11-27-9-3-1-4-10-27)23(14-20(19)26)29-15-17-7-8-22-24(12-17)31-16-30-22/h7-8,12-14H,1-6,9-11,15-16,26H2