N-[2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]propyl]-4-nitro-N-pyridin-2-yl-benzamide

Systemtic Name: N-[2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]propyl]-4-nitro-N-pyridin-2-yl-benzamide Openeye Name: N-[2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]propyl]-4-nitro-N-(2-pyridyl)benzamide CAS Name: N-[2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-piperazinyl]propyl]-4-nitro-N-(2-pyridinyl)benzamide IUPAC Name: N-[2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]propyl]-4-nitro-N-pyridin-2-ylbenzamide Traditional Name: N-[2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazino]propyl]-4-nitro-N-(2-pyridyl)benzamide Formula: C27H29N5O5 MolecularWeight: 503.54966

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C1=CC=CC=N1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])N3CCN(CC3)C4=C5C(=CC=C4)OCCO5

Isomeric SMILES

CC(CN(C1=CC=CC=N1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])N3CCN(CC3)C4=C5C(=CC=C4)OCCO5

InChI

InChI=1S/C27H29N5O5/c1-20(29-13-15-30(16-14-29)23-5-4-6-24-26(23)37-18-17-36-24)19-31(25-7-2-3-12-28-25)27(33)21-8-10-22(11-9-21)32(34)35/h2-12,20H,13-19H2,1H3