6-[bis(2-chloroethyl)amino]-2-methyl-7-nitro-1H-quinazolin-4-one

Systemtic Name: 6-[bis(2-chloroethyl)amino]-2-methyl-7-nitro-1H-quinazolin-4-one Openeye Name: 6-[bis(2-chloroethyl)amino]-2-methyl-7-nitro-1H-quinazolin-4-one CAS Name: 6-[bis(2-chloroethyl)amino]-2-methyl-7-nitro-1H-quinazolin-4-one IUPAC Name: 6-[bis(2-chloroethyl)amino]-2-methyl-7-nitro-1H-quinazolin-4-one Traditional Name: 6-[bis(2-chloroethyl)amino]-2-methyl-7-nitro-1H-quinazolin-4-one Formula: C13H14Cl2N4O3 MolecularWeight: 345.18126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=CC(=C(C=C2N1)[N+](=O)[O-])N(CCCl)CCCl

Isomeric SMILES

CC1=NC(=O)C2=CC(=C(C=C2N1)[N+](=O)[O-])N(CCCl)CCCl

InChI

InChI=1S/C13H14Cl2N4O3/c1-8-16-10-7-12(19(21)22)11(6-9(10)13(20)17-8)18(4-2-14)5-3-15/h6-7H,2-5H2,1H3,(H,16,17,20)