3-[2-(3-methyl-4-nitro-phenoxy)ethyl]quinazolin-4-one

Systemtic Name: 3-[2-(3-methyl-4-nitro-phenoxy)ethyl]quinazolin-4-one Openeye Name: 3-[2-(3-methyl-4-nitro-phenoxy)ethyl]quinazolin-4-one CAS Name: 3-[2-(3-methyl-4-nitrophenoxy)ethyl]-4-quinazolinone IUPAC Name: 3-[2-(3-methyl-4-nitrophenoxy)ethyl]quinazolin-4-one Traditional Name: 3-[2-(3-methyl-4-nitro-phenoxy)ethyl]quinazolin-4-one Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCN2C=NC3=CC=CC=C3C2=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCCN2C=NC3=CC=CC=C3C2=O)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O4/c1-12-10-13(6-7-16(12)20(22)23)24-9-8-19-11-18-15-5-3-2-4-14(15)17(19)21/h2-7,10-11H,8-9H2,1H3