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

Systemtic Name: 2-(4-methoxyphenyl)-3-[4-(4-methyl-2-nitro-phenoxy)butyl]quinazolin-4-one Openeye Name: 2-(4-methoxyphenyl)-3-[4-(4-methyl-2-nitro-phenoxy)butyl]quinazolin-4-one CAS Name: 2-(4-methoxyphenyl)-3-[4-(4-methyl-2-nitrophenoxy)butyl]-4-quinazolinone IUPAC Name: 2-(4-methoxyphenyl)-3-[4-(4-methyl-2-nitrophenoxy)butyl]quinazolin-4-one Traditional Name: 2-(4-methoxyphenyl)-3-[4-(4-methyl-2-nitro-phenoxy)butyl]quinazolin-4-one Formula: C26H25N3O5 MolecularWeight: 459.4938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C26H25N3O5/c1-18-9-14-24(23(17-18)29(31)32)34-16-6-5-15-28-25(19-10-12-20(33-2)13-11-19)27-22-8-4-3-7-21(22)26(28)30/h3-4,7-14,17H,5-6,15-16H2,1-2H3