1-cyclohexyl-3-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]urea

Systemtic Name: 1-cyclohexyl-3-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]urea Openeye Name: 1-cyclohexyl-3-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxo-propyl]urea CAS Name: 1-cyclohexyl-3-[3-[4-(4-nitrophenyl)-1-piperazinyl]-3-oxopropyl]urea IUPAC Name: 1-cyclohexyl-3-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxopropyl]urea Traditional Name: 1-cyclohexyl-3-[3-keto-3-[4-(4-nitrophenyl)piperazino]propyl]urea Formula: C20H29N5O4 MolecularWeight: 403.47536

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)NCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H29N5O4/c26-19(10-11-21-20(27)22-16-4-2-1-3-5-16)24-14-12-23(13-15-24)17-6-8-18(9-7-17)25(28)29/h6-9,16H,1-5,10-15H2,(H2,21,22,27)