7-chloranyl-N-[(4-chlorophenyl)methyl]-5-nitro-1,2,3,4-tetrahydroxanthen-4a-amine

Systemtic Name: 7-chloranyl-N-[(4-chlorophenyl)methyl]-5-nitro-1,2,3,4-tetrahydroxanthen-4a-amine Openeye Name: 7-chloro-N-[(4-chlorophenyl)methyl]-5-nitro-1,2,3,4-tetrahydroxanthen-4a-amine CAS Name: 7-chloro-N-[(4-chlorophenyl)methyl]-5-nitro-1,2,3,4-tetrahydroxanthen-4a-amine IUPAC Name: 7-chloro-N-[(4-chlorophenyl)methyl]-5-nitro-1,2,3,4-tetrahydroxanthen-4a-amine Traditional Name: (4-chlorobenzyl)-(7-chloro-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)amine Formula: C20H18Cl2N2O3 MolecularWeight: 405.27452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C(=CC3=CC(=CC(=C3O2)[N+](=O)[O-])Cl)C1)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC2(C(=CC3=CC(=CC(=C3O2)[N+](=O)[O-])Cl)C1)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H18Cl2N2O3/c21-16-6-4-13(5-7-16)12-23-20-8-2-1-3-15(20)9-14-10-17(22)11-18(24(25)26)19(14)27-20/h4-7,9-11,23H,1-3,8,12H2