3-[2-[6-chloranyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethyl]-1-(2-chloroethyl)-1-nitroso-urea

Systemtic Name: 3-[2-[6-chloranyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethyl]-1-(2-chloroethyl)-1-nitroso-urea Openeye Name: 3-[2-(6-chloro-1,3-dioxo-benzo[de]isoquinolin-2-yl)ethyl]-1-(2-chloroethyl)-1-nitroso-urea CAS Name: 3-[2-(6-chloro-1,3-dioxo-2-benzo[de]isoquinolinyl)ethyl]-1-(2-chloroethyl)-1-nitrosourea IUPAC Name: 3-[2-(6-chloro-1,3-dioxobenzo[de]isoquinolin-2-yl)ethyl]-1-(2-chloroethyl)-1-nitrosourea Traditional Name: 3-[2-(6-chloro-1,3-diketo-benzo[de]isoquinolin-2-yl)ethyl]-1-(2-chloroethyl)-1-nitroso-urea Formula: C17H14Cl2N4O4 MolecularWeight: 409.22346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)CCNC(=O)N(CCCl)N=O)Cl

Isomeric SMILES

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)CCNC(=O)N(CCCl)N=O)Cl

InChI

InChI=1S/C17H14Cl2N4O4/c18-6-8-23(21-27)17(26)20-7-9-22-15(24)11-3-1-2-10-13(19)5-4-12(14(10)11)16(22)25/h1-5H,6-9H2,(H,20,26)