4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)-N-(3,4-dimethylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)-N-(3,4-dimethylphenyl)piperazine-1-carboxamide Openeye Name: 4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)-N-(3,4-dimethylphenyl)piperazine-1-carboxamide CAS Name: 4-[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]-N-(3,4-dimethylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)-N-(3,4-dimethylphenyl)piperazine-1-carboxamide Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-3-carbonyl)-N-(3,4-dimethylphenyl)piperazine-1-carboxamide Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3)C

InChI

InChI=1S/C22H25N3O4/c1-15-7-8-17(13-16(15)2)23-22(27)25-11-9-24(10-12-25)21(26)20-14-28-18-5-3-4-6-19(18)29-20/h3-8,13,20H,9-12,14H2,1-2H3,(H,23,27)