[2-(2,3-dihydro-1,4-benzodioxin-6-yl)quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-quinolyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-quinolinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-quinolyl]-(4-phenylpiperazino)methanone Formula: C28H25N3O3 MolecularWeight: 451.5164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC6=C(C=C5)OCCO6

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC6=C(C=C5)OCCO6

InChI

InChI=1S/C28H25N3O3/c32-28(31-14-12-30(13-15-31)21-6-2-1-3-7-21)23-19-25(29-24-9-5-4-8-22(23)24)20-10-11-26-27(18-20)34-17-16-33-26/h1-11,18-19H,12-17H2