6-nitro-4-phenyl-1-(piperidin-4-ylmethyl)quinazolin-2-one

Systemtic Name: 6-nitro-4-phenyl-1-(piperidin-4-ylmethyl)quinazolin-2-one Openeye Name: 6-nitro-4-phenyl-1-(4-piperidylmethyl)quinazolin-2-one CAS Name: 6-nitro-4-phenyl-1-(4-piperidinylmethyl)-2-quinazolinone IUPAC Name: 6-nitro-4-phenyl-1-(piperidin-4-ylmethyl)quinazolin-2-one Traditional Name: 6-nitro-4-phenyl-1-(4-piperidylmethyl)quinazolin-2-one Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=NC2=O)C4=CC=CC=C4

Isomeric SMILES

C1CNCCC1CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=NC2=O)C4=CC=CC=C4

InChI

InChI=1S/C20H20N4O3/c25-20-22-19(15-4-2-1-3-5-15)17-12-16(24(26)27)6-7-18(17)23(20)13-14-8-10-21-11-9-14/h1-7,12,14,21H,8-11,13H2