3-[(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl]-6-nitro-quinazolin-4-one

Systemtic Name: 3-[(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl]-6-nitro-quinazolin-4-one Openeye Name: 3-[(6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl]-6-nitro-quinazolin-4-one CAS Name: 3-[(6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl]-6-nitro-4-quinazolinone IUPAC Name: 3-[(6-chloro-7-methyl-2-oxochromen-4-yl)methyl]-6-nitroquinazolin-4-one Traditional Name: 3-[(6-chloro-2-keto-7-methyl-chromen-4-yl)methyl]-6-nitro-quinazolin-4-one Formula: C19H12ClN3O5 MolecularWeight: 397.76868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3C=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3C=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H12ClN3O5/c1-10-4-17-13(7-15(10)20)11(5-18(24)28-17)8-22-9-21-16-3-2-12(23(26)27)6-14(16)19(22)25/h2-7,9H,8H2,1H3