[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(5-methyl-2-phenyl-1,2,3-triazol-4-yl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(5-methyl-2-phenyl-1,2,3-triazol-4-yl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(5-methyl-2-phenyl-triazol-4-yl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(5-methyl-2-phenyl-4-triazolyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(5-methyl-2-phenyltriazol-4-yl)methanone Traditional Name: (5-methyl-2-phenyl-triazol-4-yl)-(4-piperonylpiperazino)methanone Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(N=C1C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C22H23N5O3/c1-16-21(24-27(23-16)18-5-3-2-4-6-18)22(28)26-11-9-25(10-12-26)14-17-7-8-19-20(13-17)30-15-29-19/h2-8,13H,9-12,14-15H2,1H3