N-[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-4-(2-methylphenyl)piperazine-1-carboxamide

Systemtic Name: N-[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-4-(2-methylphenyl)piperazine-1-carboxamide Openeye Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-4-(o-tolyl)piperazine-1-carboxamide CAS Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-4-(2-methylphenyl)-1-piperazinecarboxamide IUPAC Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-4-(2-methylphenyl)piperazine-1-carboxamide Traditional Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-4-(o-tolyl)piperazine-1-carboxamide Formula: C22H26ClN3O3 MolecularWeight: 415.91314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)NCCC3=CC4=C(C(=C3)Cl)OCCO4

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)NCCC3=CC4=C(C(=C3)Cl)OCCO4

InChI

InChI=1S/C22H26ClN3O3/c1-16-4-2-3-5-19(16)25-8-10-26(11-9-25)22(27)24-7-6-17-14-18(23)21-20(15-17)28-12-13-29-21/h2-5,14-15H,6-13H2,1H3,(H,24,27)