[4-(4-nitrophenyl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone

Systemtic Name: [4-(4-nitrophenyl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone Openeye Name: [4-(4-nitrophenyl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone CAS Name: [4-(4-nitrophenyl)-1-piperazinyl]-(3,4,5-triethoxyphenyl)methanone IUPAC Name: [4-(4-nitrophenyl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone Traditional Name: [4-(4-nitrophenyl)piperazino]-(3,4,5-triethoxyphenyl)methanone Formula: C23H29N3O6 MolecularWeight: 443.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O6/c1-4-30-20-15-17(16-21(31-5-2)22(20)32-6-3)23(27)25-13-11-24(12-14-25)18-7-9-19(10-8-18)26(28)29/h7-10,15-16H,4-6,11-14H2,1-3H3