[2-(1,3-benzodioxol-5-yl)quinolin-4-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [2-(1,3-benzodioxol-5-yl)quinolin-4-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone Openeye Name: [2-(1,3-benzodioxol-5-yl)-4-quinolyl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone CAS Name: [2-(1,3-benzodioxol-5-yl)-4-quinolinyl]-[4-(2-ethoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [2-(1,3-benzodioxol-5-yl)quinolin-4-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone Traditional Name: [2-(1,3-benzodioxol-5-yl)-4-quinolyl]-(4-o-phenetylpiperazino)methanone Formula: C29H27N3O4 MolecularWeight: 481.54238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C29H27N3O4/c1-2-34-26-10-6-5-9-25(26)31-13-15-32(16-14-31)29(33)22-18-24(30-23-8-4-3-7-21(22)23)20-11-12-27-28(17-20)36-19-35-27/h3-12,17-18H,2,13-16,19H2,1H3