1-decyl-6-nitro-4-phenyl-quinazolin-2-one

Systemtic Name: 1-decyl-6-nitro-4-phenyl-quinazolin-2-one Openeye Name: 1-decyl-6-nitro-4-phenyl-quinazolin-2-one CAS Name: 1-decyl-6-nitro-4-phenyl-2-quinazolinone IUPAC Name: 1-decyl-6-nitro-4-phenylquinazolin-2-one Traditional Name: 1-decyl-6-nitro-4-phenyl-quinazolin-2-one Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=NC1=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=NC1=O)C3=CC=CC=C3

InChI

InChI=1S/C24H29N3O3/c1-2-3-4-5-6-7-8-12-17-26-22-16-15-20(27(29)30)18-21(22)23(25-24(26)28)19-13-10-9-11-14-19/h9-11,13-16,18H,2-8,12,17H2,1H3