6,8-bis(chloranyl)-3-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-chromen-2-one

Systemtic Name: 6,8-bis(chloranyl)-3-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 6,8-dichloro-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]chromen-2-one CAS Name: 6,8-dichloro-3-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 6,8-dichloro-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]chromen-2-one Traditional Name: 6,8-dichloro-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]coumarin Formula: C20H15Cl2N3O5 MolecularWeight: 448.2562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC4=CC(=CC(=C4OC3=O)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC4=CC(=CC(=C4OC3=O)Cl)Cl

InChI

InChI=1S/C20H15Cl2N3O5/c21-13-9-12-10-16(20(27)30-18(12)17(22)11-13)19(26)24-7-5-23(6-8-24)14-1-3-15(4-2-14)25(28)29/h1-4,9-11H,5-8H2