[4-(cyclopropylamino)-3-nitro-phenyl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [4-(cyclopropylamino)-3-nitro-phenyl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [4-(cyclopropylamino)-3-nitro-phenyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [4-(cyclopropylamino)-3-nitrophenyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [4-(cyclopropylamino)-3-nitrophenyl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [4-(cyclopropylamino)-3-nitro-phenyl]-(4-phenylpiperazino)methanone Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O3/c25-20(23-12-10-22(11-13-23)17-4-2-1-3-5-17)15-6-9-18(21-16-7-8-16)19(14-15)24(26)27/h1-6,9,14,16,21H,7-8,10-13H2