[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[4-(4-methyl-1-piperidyl)-3-nitro-phenyl]methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[4-(4-methyl-1-piperidinyl)-3-nitrophenyl]methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[4-(4-methylpiperidin-1-yl)-3-nitrophenyl]methanone Traditional Name: [4-(4-methylpiperidino)-3-nitro-phenyl]-(4-piperonylpiperazino)methanone Formula: C25H30N4O5 MolecularWeight: 466.5295

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)[N+](=O)[O-]

InChI

InChI=1S/C25H30N4O5/c1-18-6-8-27(9-7-18)21-4-3-20(15-22(21)29(31)32)25(30)28-12-10-26(11-13-28)16-19-2-5-23-24(14-19)34-17-33-23/h2-5,14-15,18H,6-13,16-17H2,1H3