[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-(2,4,6-trimethylphenyl)methanone

Systemtic Name: [4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-(2,4,6-trimethylphenyl)methanone Openeye Name: [4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-(2,4,6-trimethylphenyl)methanone CAS Name: [4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]-(2,4,6-trimethylphenyl)methanone IUPAC Name: [4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]-(2,4,6-trimethylphenyl)methanone Traditional Name: mesityl-[4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazino]methanone Formula: C24H26N4O3 MolecularWeight: 418.48824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])N4C=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])N4C=CC=C4)C

InChI

InChI=1S/C24H26N4O3/c1-17-14-18(2)23(19(3)15-17)24(29)27-12-10-26(11-13-27)21-7-6-20(28(30)31)16-22(21)25-8-4-5-9-25/h4-9,14-16H,10-13H2,1-3H3