6-nitro-3-(3-phenoxypropyl)quinazolin-4-one

Systemtic Name: 6-nitro-3-(3-phenoxypropyl)quinazolin-4-one Openeye Name: 6-nitro-3-(3-phenoxypropyl)quinazolin-4-one CAS Name: 6-nitro-3-(3-phenoxypropyl)-4-quinazolinone IUPAC Name: 6-nitro-3-(3-phenoxypropyl)quinazolin-4-one Traditional Name: 6-nitro-3-(3-phenoxypropyl)quinazolin-4-one Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCCN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O4/c21-17-15-11-13(20(22)23)7-8-16(15)18-12-19(17)9-4-10-24-14-5-2-1-3-6-14/h1-3,5-8,11-12H,4,9-10H2