[4-(cyclooctylamino)-3-nitro-phenyl]-phenyl-methanone

Systemtic Name: [4-(cyclooctylamino)-3-nitro-phenyl]-phenyl-methanone Openeye Name: [4-(cyclooctylamino)-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-(cyclooctylamino)-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-(cyclooctylamino)-3-nitrophenyl]-phenylmethanone Traditional Name: [4-(cyclooctylamino)-3-nitro-phenyl]-phenyl-methanone Formula: C21H24N2O3 MolecularWeight: 352.42686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCC(CCC1)NC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N2O3/c24-21(16-9-5-4-6-10-16)17-13-14-19(20(15-17)23(25)26)22-18-11-7-2-1-3-8-12-18/h4-6,9-10,13-15,18,22H,1-3,7-8,11-12H2