4-bromanyl-1-(cyclohexylamino)-6-nitro-anthracene-9,10-dione

Systemtic Name: 4-bromanyl-1-(cyclohexylamino)-6-nitro-anthracene-9,10-dione Openeye Name: 4-bromo-1-(cyclohexylamino)-6-nitro-anthracene-9,10-dione CAS Name: 4-bromo-1-(cyclohexylamino)-6-nitroanthracene-9,10-dione IUPAC Name: 4-bromo-1-(cyclohexylamino)-6-nitroanthracene-9,10-dione Traditional Name: 4-bromo-1-(cyclohexylamino)-6-nitro-9,10-anthraquinone Formula: C20H17BrN2O4 MolecularWeight: 429.26398

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C3C(=C(C=C2)Br)C(=O)C4=C(C3=O)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC2=C3C(=C(C=C2)Br)C(=O)C4=C(C3=O)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H17BrN2O4/c21-15-8-9-16(22-11-4-2-1-3-5-11)18-17(15)20(25)14-10-12(23(26)27)6-7-13(14)19(18)24/h6-11,22H,1-5H2