N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[2-[4-(4-methoxyphenyl)piperazino]ethyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCNC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCNC(=O)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C22H27N3O4/c1-27-18-8-6-17(7-9-18)25-14-12-24(13-15-25)11-10-23-22(26)21-16-28-19-4-2-3-5-20(19)29-21/h2-9,21H,10-16H2,1H3,(H,23,26)