1-(3-cycloheptyl-2-methyl-phenyl)-3-(4-nitrophenyl)urea

Systemtic Name: 1-(3-cycloheptyl-2-methyl-phenyl)-3-(4-nitrophenyl)urea Openeye Name: 1-(3-cycloheptyl-2-methyl-phenyl)-3-(4-nitrophenyl)urea CAS Name: 1-(3-cycloheptyl-2-methylphenyl)-3-(4-nitrophenyl)urea IUPAC Name: 1-(3-cycloheptyl-2-methylphenyl)-3-(4-nitrophenyl)urea Traditional Name: 1-(3-cycloheptyl-2-methyl-phenyl)-3-(4-nitrophenyl)urea Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C3CCCCCC3

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C3CCCCCC3

InChI

InChI=1S/C21H25N3O3/c1-15-19(16-7-4-2-3-5-8-16)9-6-10-20(15)23-21(25)22-17-11-13-18(14-12-17)24(26)27/h6,9-14,16H,2-5,7-8H2,1H3,(H2,22,23,25)