4-(4-chlorophenyl)carbonyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperazine-1-carboxamide

Systemtic Name: 4-(4-chlorophenyl)carbonyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperazine-1-carboxamide Openeye Name: 4-(4-chlorobenzoyl)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperazine-1-carboxamide CAS Name: 4-[(4-chlorophenyl)-oxomethyl]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-piperazinecarboxamide IUPAC Name: 4-(4-chlorobenzoyl)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperazine-1-carboxamide Traditional Name: 4-(4-chlorobenzoyl)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperazine-1-carboxamide Formula: C21H22ClN3O4 MolecularWeight: 415.87008

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)Cl)C(=O)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)Cl)C(=O)NCC3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H22ClN3O4/c22-16-7-5-15(6-8-16)20(26)24-9-11-25(12-10-24)21(27)23-13-17-14-28-18-3-1-2-4-19(18)29-17/h1-8,17H,9-14H2,(H,23,27)