[4-(dimethylamino)-2-methoxy-5-nitro-phenyl]-[(3S)-3-methyl-4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(dimethylamino)-2-methoxy-5-nitro-phenyl]-[(3S)-3-methyl-4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [4-(dimethylamino)-2-methoxy-5-nitro-phenyl]-[(3S)-3-methyl-4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [4-(dimethylamino)-2-methoxy-5-nitrophenyl]-[(3S)-3-methyl-4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [4-(dimethylamino)-2-methoxy-5-nitrophenyl]-[(3S)-3-methyl-4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [4-(dimethylamino)-2-methoxy-5-nitro-phenyl]-[(3S)-3-methyl-4-(4-nitrophenyl)piperazino]methanone Formula: C21H25N5O6 MolecularWeight: 443.4531

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=C(C=C3OC)N(C)C)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=C(C=C3OC)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O6/c1-14-13-23(9-10-24(14)15-5-7-16(8-6-15)25(28)29)21(27)17-11-19(26(30)31)18(22(2)3)12-20(17)32-4/h5-8,11-12,14H,9-10,13H2,1-4H3/t14-/m0/s1