1-(1-adamantyl)-3-[4-(4-nitrophenoxy)phenyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[4-(4-nitrophenoxy)phenyl]urea Openeye Name: 1-(1-adamantyl)-3-[4-(4-nitrophenoxy)phenyl]urea CAS Name: 1-(1-adamantyl)-3-[4-(4-nitrophenoxy)phenyl]urea IUPAC Name: 1-(1-adamantyl)-3-[4-(4-nitrophenoxy)phenyl]urea Traditional Name: 1-(1-adamantyl)-3-[4-(4-nitrophenoxy)phenyl]urea Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC4=CC=C(C=C4)OC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NC4=CC=C(C=C4)OC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O4/c27-22(25-23-12-15-9-16(13-23)11-17(10-15)14-23)24-18-1-5-20(6-2-18)30-21-7-3-19(4-8-21)26(28)29/h1-8,15-17H,9-14H2,(H2,24,25,27)