N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-3-chloranyl-2,2-dimethyl-propanamide

Systemtic Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-3-chloranyl-2,2-dimethyl-propanamide Openeye Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-2-methyl-propyl]-3-chloro-2,2-dimethyl-propanamide CAS Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-3-chloro-2,2-dimethylpropanamide IUPAC Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]-3-chloro-2,2-dimethylpropanamide Traditional Name: 3-chloro-2,2-dimethyl-N-[2-methyl-1-(4-piperonylpiperazine-1-carbonyl)propyl]propionamide Formula: C22H32ClN3O4 MolecularWeight: 437.96018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)NC(=O)C(C)(C)CCl

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)NC(=O)C(C)(C)CCl

InChI

InChI=1S/C22H32ClN3O4/c1-15(2)19(24-21(28)22(3,4)13-23)20(27)26-9-7-25(8-10-26)12-16-5-6-17-18(11-16)30-14-29-17/h5-6,11,15,19H,7-10,12-14H2,1-4H3,(H,24,28)