[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-(4-nitrophenyl)methanone

Systemtic Name: [4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-(4-nitrophenyl)methanone Openeye Name: [4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-(4-nitrophenyl)methanone CAS Name: [4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-(4-nitrophenyl)methanone IUPAC Name: [4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-(4-nitrophenyl)methanone Traditional Name: (4-nitrophenyl)-(4-veratroylpiperazino)methanone Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H21N3O6/c1-28-17-8-5-15(13-18(17)29-2)20(25)22-11-9-21(10-12-22)19(24)14-3-6-16(7-4-14)23(26)27/h3-8,13H,9-12H2,1-2H3