N-[1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-3-pyridin-3-yl-propan-2-yl]-1-methyl-cyclohexane-1-carboxamide

Systemtic Name: N-[1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-3-pyridin-3-yl-propan-2-yl]-1-methyl-cyclohexane-1-carboxamide Openeye Name: N-[1-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]methyl]-2-(3-pyridyl)ethyl]-1-methyl-cyclohexanecarboxamide CAS Name: N-[1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-piperazinyl]-3-(3-pyridinyl)propan-2-yl]-1-methyl-1-cyclohexanecarboxamide IUPAC Name: N-[1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-3-pyridin-3-ylpropan-2-yl]-1-methylcyclohexane-1-carboxamide Traditional Name: N-[1-[[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazino]methyl]-2-(3-pyridyl)ethyl]-1-methyl-cyclohexanecarboxamide Formula: C28H38N4O3 MolecularWeight: 478.62632

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1)C(=O)NC(CC2=CN=CC=C2)CN3CCN(CC3)C4=C5C(=CC=C4)OCCO5

Isomeric SMILES

CC1(CCCCC1)C(=O)NC(CC2=CN=CC=C2)CN3CCN(CC3)C4=C5C(=CC=C4)OCCO5

InChI

InChI=1S/C28H38N4O3/c1-28(10-3-2-4-11-28)27(33)30-23(19-22-7-6-12-29-20-22)21-31-13-15-32(16-14-31)24-8-5-9-25-26(24)35-18-17-34-25/h5-9,12,20,23H,2-4,10-11,13-19,21H2,1H3,(H,30,33)