(3,4-dimethoxyphenyl)-[4-(2-nitro-2-phenyl-1,3-dioxolan-4-yl)piperazin-1-yl]methanone

Systemtic Name: (3,4-dimethoxyphenyl)-[4-(2-nitro-2-phenyl-1,3-dioxolan-4-yl)piperazin-1-yl]methanone Openeye Name: (3,4-dimethoxyphenyl)-[4-(2-nitro-2-phenyl-1,3-dioxolan-4-yl)piperazin-1-yl]methanone CAS Name: (3,4-dimethoxyphenyl)-[4-(2-nitro-2-phenyl-1,3-dioxolan-4-yl)-1-piperazinyl]methanone IUPAC Name: (3,4-dimethoxyphenyl)-[4-(2-nitro-2-phenyl-1,3-dioxolan-4-yl)piperazin-1-yl]methanone Traditional Name: (3,4-dimethoxyphenyl)-[4-(2-nitro-2-phenyl-1,3-dioxolan-4-yl)piperazino]methanone Formula: C22H25N3O7 MolecularWeight: 443.4498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3COC(O3)(C4=CC=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3COC(O3)(C4=CC=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C22H25N3O7/c1-29-18-9-8-16(14-19(18)30-2)21(26)24-12-10-23(11-13-24)20-15-31-22(32-20,25(27)28)17-6-4-3-5-7-17/h3-9,14,20H,10-13,15H2,1-2H3