1-(4-methoxy-2-nitro-phenyl)-3-[2-(4-methyl-2-phenyl-piperazin-1-yl)ethyl]urea

Systemtic Name: 1-(4-methoxy-2-nitro-phenyl)-3-[2-(4-methyl-2-phenyl-piperazin-1-yl)ethyl]urea Openeye Name: 1-(4-methoxy-2-nitro-phenyl)-3-[2-(4-methyl-2-phenyl-piperazin-1-yl)ethyl]urea CAS Name: 1-(4-methoxy-2-nitrophenyl)-3-[2-(4-methyl-2-phenyl-1-piperazinyl)ethyl]urea IUPAC Name: 1-(4-methoxy-2-nitrophenyl)-3-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]urea Traditional Name: 1-(4-methoxy-2-nitro-phenyl)-3-[2-(4-methyl-2-phenyl-piperazino)ethyl]urea Formula: C21H27N5O4 MolecularWeight: 413.47018

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(C1)C2=CC=CC=C2)CCNC(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(C(C1)C2=CC=CC=C2)CCNC(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H27N5O4/c1-24-12-13-25(20(15-24)16-6-4-3-5-7-16)11-10-22-21(27)23-18-9-8-17(30-2)14-19(18)26(28)29/h3-9,14,20H,10-13,15H2,1-2H3,(H2,22,23,27)