6-nitro-7-(3-phenoxypropylamino)-1H-quinazolin-4-one

Systemtic Name: 6-nitro-7-(3-phenoxypropylamino)-1H-quinazolin-4-one Openeye Name: 6-nitro-7-(3-phenoxypropylamino)-1H-quinazolin-4-one CAS Name: 6-nitro-7-(3-phenoxypropylamino)-1H-quinazolin-4-one IUPAC Name: 6-nitro-7-(3-phenoxypropylamino)-1H-quinazolin-4-one Traditional Name: 6-nitro-7-(3-phenoxypropylamino)-1H-quinazolin-4-one Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCNC2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCCNC2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O4/c22-17-13-9-16(21(23)24)15(10-14(13)19-11-20-17)18-7-4-8-25-12-5-2-1-3-6-12/h1-3,5-6,9-11,18H,4,7-8H2,(H,19,20,22)