3-(1-adamantyl)-1-methyl-1-[2-(4-nitrophenyl)ethyl]urea

Systemtic Name: 3-(1-adamantyl)-1-methyl-1-[2-(4-nitrophenyl)ethyl]urea Openeye Name: 3-(1-adamantyl)-1-methyl-1-[2-(4-nitrophenyl)ethyl]urea CAS Name: 3-(1-adamantyl)-1-methyl-1-[2-(4-nitrophenyl)ethyl]urea IUPAC Name: 3-(1-adamantyl)-1-methyl-1-[2-(4-nitrophenyl)ethyl]urea Traditional Name: 3-(1-adamantyl)-1-methyl-1-[2-(4-nitrophenyl)ethyl]urea Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(CCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H27N3O3/c1-22(7-6-14-2-4-18(5-3-14)23(25)26)19(24)21-20-11-15-8-16(12-20)10-17(9-15)13-20/h2-5,15-17H,6-13H2,1H3,(H,21,24)