3-[2-(4-butylphenyl)-2-oxidanylidene-ethyl]-6-nitro-quinazolin-4-one

Systemtic Name: 3-[2-(4-butylphenyl)-2-oxidanylidene-ethyl]-6-nitro-quinazolin-4-one Openeye Name: 3-[2-(4-butylphenyl)-2-oxo-ethyl]-6-nitro-quinazolin-4-one CAS Name: 3-[2-(4-butylphenyl)-2-oxoethyl]-6-nitro-4-quinazolinone IUPAC Name: 3-[2-(4-butylphenyl)-2-oxoethyl]-6-nitroquinazolin-4-one Traditional Name: 3-[2-(4-butylphenyl)-2-keto-ethyl]-6-nitro-quinazolin-4-one Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O4/c1-2-3-4-14-5-7-15(8-6-14)19(24)12-22-13-21-18-10-9-16(23(26)27)11-17(18)20(22)25/h5-11,13H,2-4,12H2,1H3