[4-[2-(2,5-dimethylpyrrol-1-yl)-4-nitro-phenyl]piperazin-1-yl]-phenyl-methanone; methanol

Systemtic Name: [4-[2-(2,5-dimethylpyrrol-1-yl)-4-nitro-phenyl]piperazin-1-yl]-phenyl-methanone; methanol Openeye Name: [4-[2-(2,5-dimethylpyrrol-1-yl)-4-nitro-phenyl]piperazin-1-yl]-phenyl-methanone; methanol CAS Name: [4-[2-(2,5-dimethyl-1-pyrrolyl)-4-nitrophenyl]-1-piperazinyl]-phenylmethanone; methanol IUPAC Name: [4-[2-(2,5-dimethylpyrrol-1-yl)-4-nitrophenyl]piperazin-1-yl]-phenylmethanone; methanol Traditional Name: [4-[2-(2,5-dimethylpyrrol-1-yl)-4-nitro-phenyl]piperazino]-phenyl-methanone; methanol Formula: C24H28N4O4 MolecularWeight: 436.50352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C=CC(=C2)[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CC=C4)C.CO

Isomeric SMILES

CC1=CC=C(N1C2=C(C=CC(=C2)[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CC=C4)C.CO

InChI

InChI=1S/C23H24N4O3.CH4O/c1-17-8-9-18(2)26(17)22-16-20(27(29)30)10-11-21(22)24-12-14-25(15-13-24)23(28)19-6-4-3-5-7-19;1-2/h3-11,16H,12-15H2,1-2H3;2H,1H3