3-ethyl-2-heptadecyl-7-nitro-quinazolin-4-one

Systemtic Name: 3-ethyl-2-heptadecyl-7-nitro-quinazolin-4-one Openeye Name: 3-ethyl-2-heptadecyl-7-nitro-quinazolin-4-one CAS Name: 3-ethyl-2-heptadecyl-7-nitro-4-quinazolinone IUPAC Name: 3-ethyl-2-heptadecyl-7-nitroquinazolin-4-one Traditional Name: 3-ethyl-2-heptadecyl-7-nitro-quinazolin-4-one Formula: C27H43N3O3 MolecularWeight: 457.64862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1CC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1CC

InChI

InChI=1S/C27H43N3O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26-28-25-22-23(30(32)33)20-21-24(25)27(31)29(26)4-2/h20-22H,3-19H2,1-2H3