[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]-[4-(phenoxymethyl)phenyl]methanone

Systemtic Name: [4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]-[4-(phenoxymethyl)phenyl]methanone Openeye Name: [4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]-[4-(phenoxymethyl)phenyl]methanone CAS Name: [4-(4-methoxy-2-nitrophenyl)-1-piperazinyl]-[4-(phenoxymethyl)phenyl]methanone IUPAC Name: [4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]-[4-(phenoxymethyl)phenyl]methanone Traditional Name: [4-(4-methoxy-2-nitro-phenyl)piperazino]-[4-(phenoxymethyl)phenyl]methanone Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)COC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)COC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H25N3O5/c1-32-22-11-12-23(24(17-22)28(30)31)26-13-15-27(16-14-26)25(29)20-9-7-19(8-10-20)18-33-21-5-3-2-4-6-21/h2-12,17H,13-16,18H2,1H3