N-[1-[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-4-methyl-3-nitro-N-pentyl-benzamide

Systemtic Name: N-[1-[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-4-methyl-3-nitro-N-pentyl-benzamide Openeye Name: N-[1-[3-(4-fluorophenyl)-4-oxo-quinazolin-2-yl]propyl]-4-methyl-3-nitro-N-pentyl-benzamide CAS Name: N-[1-[3-(4-fluorophenyl)-4-oxo-2-quinazolinyl]propyl]-4-methyl-3-nitro-N-pentylbenzamide IUPAC Name: N-[1-[3-(4-fluorophenyl)-4-oxoquinazolin-2-yl]propyl]-4-methyl-3-nitro-N-pentylbenzamide Traditional Name: N-amyl-N-[1-[3-(4-fluorophenyl)-4-keto-quinazolin-2-yl]propyl]-4-methyl-3-nitro-benzamide Formula: C30H31FN4O4 MolecularWeight: 530.589943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)F)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)F)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C30H31FN4O4/c1-4-6-9-18-33(29(36)21-13-12-20(3)27(19-21)35(38)39)26(5-2)28-32-25-11-8-7-10-24(25)30(37)34(28)23-16-14-22(31)15-17-23/h7-8,10-17,19,26H,4-6,9,18H2,1-3H3